data_2m2d_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 2m2d _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 48.4 m . . . . . 0 N--CA 1.469 0.509 0 CA-C-O 121.05 0.452 . . . . 0.0 110.063 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -147.0 119.71 8.59 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.894 1.677 . . . . 0.0 109.385 178.026 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 88.3 p -140.85 159.13 63.47 Favored Pre-proline 0 CA--C 1.548 0.904 0 N-CA-C 113.831 1.048 . . . . 0.0 113.831 -168.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -70.06 160.75 88.38 Favored 'Cis proline' 0 C--N 1.355 0.893 0 CA-C-N 119.33 0.796 . . . . 0.0 111.513 -5.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.38 -20.52 66.42 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 176.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 36.5 tp -141.45 116.89 10.18 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 125.43 1.492 . . . . 0.0 108.819 169.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 61.2 tp -104.71 121.81 44.37 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.282 1.433 . . . . 0.0 108.856 170.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 24.0 t -110.67 122.08 64.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 124.251 1.02 . . . . 0.0 108.311 174.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 27.8 m -133.01 167.67 26.1 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 C-N-CA 124.849 1.26 . . . . 0.0 111.777 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.3 m -93.7 150.97 19.97 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.0 1.32 . . . . 0.0 110.66 174.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -46.5 125.67 7.24 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.71 1.204 . . . . 0.0 111.703 168.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.96 -1.11 82.93 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 125.906 1.717 . . . . 0.0 114.813 -179.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -74.67 151.82 39.22 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 119.801 1.801 . . . . 0.0 112.65 173.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 68.0 m-20 -86.64 88.19 7.61 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.2 1.0 . . . . 0.0 109.188 171.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -77.08 114.42 15.86 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.723 0.809 . . . . 0.0 112.351 -167.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 53.0 m -116.27 130.58 56.85 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -171.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -108.57 159.6 16.58 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 127.056 2.142 . . . . 0.0 110.027 168.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 87.9 m -112.97 126.34 55.38 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.375 1.07 . . . . 0.0 110.542 175.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 29.9 m -98.31 148.88 23.2 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.152 0.981 . . . . 0.0 110.215 167.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 39.3 t -139.06 127.4 22.81 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.327 1.051 . . . . 0.0 109.443 172.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 . . . . . 0 N--CA 1.467 0.397 0 C-N-CA 124.861 1.264 . . . . 0.0 112.411 -173.089 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 52.4 p90 . . . . . 0 CA--C 1.541 0.63 0 CA-C-O 120.851 0.358 . . . . 0.0 111.836 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 45.6 t -95.9 132.89 38.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 125.326 1.45 . . . . 0.0 107.765 169.098 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 10.7 tp -99.41 142.43 30.9 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.418 1.487 . . . . 0.0 108.008 168.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -145.56 158.97 43.77 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.409 1.084 . . . . 0.0 113.191 -176.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 16.1 t90 -134.43 141.04 46.68 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.438 1.095 . . . . 0.0 112.512 -170.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -136.92 147.99 46.73 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -172.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 55.5 ttt85 -99.78 129.99 45.94 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 166.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 24.7 tpp -98.49 127.31 44.37 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.258 1.823 . . . . 0.0 109.382 179.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 44.9 m -90.84 160.59 37.91 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 125.469 1.508 . . . . 0.0 113.052 -174.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -67.44 -18.7 49.53 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 123.263 2.642 . . . . 0.0 112.827 173.024 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 42.5 p -76.92 -3.78 40.5 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.657 1.583 . . . . 0.0 113.367 169.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 32.0 m-80 73.77 20.8 2.88 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 128.287 2.635 . . . . 0.0 113.464 179.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.3 pp0? -97.75 169.59 9.57 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.818 0.847 . . . . 0.0 111.497 169.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.6 p -130.16 137.34 50.06 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.181 1.393 . . . . 0.0 110.395 -176.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -118.65 131.53 56.17 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.825 1.25 . . . . 0.0 111.219 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 76.9 tttt -75.93 132.44 40.26 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.73 1.212 . . . . 0.0 111.323 -175.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 76.1 mt -111.48 -47.14 3.2 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.689 1.196 . . . . 0.0 112.435 -170.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -167.74 169.72 11.48 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.607 1.563 . . . . 0.0 110.938 -175.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -158.72 159.39 35.19 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.078 1.351 . . . . 0.0 112.501 -177.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -145.78 118.26 5.15 Favored Pre-proline 0 CA--C 1.548 0.9 0 C-N-CA 125.676 1.591 . . . . 0.0 110.866 175.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo . . . . . 0 C--N 1.351 0.676 0 CA-C-N 119.997 1.035 . . . . 0.0 112.592 -12.427 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 41.0 mtm180 . . . . . 0 N--CA 1.471 0.602 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -67.61 111.28 4.09 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.397 1.079 . . . . 0.0 110.038 171.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 44.3 ttp85 -120.5 139.8 52.36 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.351 1.86 . . . . 0.0 111.436 -173.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 8.6 t -109.82 131.23 61.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 125.021 1.328 . . . . 0.0 108.845 168.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 73.7 m -130.12 135.73 48.53 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.326 1.05 . . . . 0.0 109.731 172.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -92.7 126.97 38.02 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.047 1.339 . . . . 0.0 109.464 -176.025 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 86.6 mt -90.66 151.48 43.94 Favored Pre-proline 0 N--CA 1.472 0.662 0 C-N-CA 123.837 0.855 . . . . 0.0 112.968 -174.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -64.62 -2.41 5.18 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 123.783 2.989 . . . . 0.0 114.058 176.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -64.92 -25.97 68.11 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 119.572 1.078 . . . . 0.0 112.648 169.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 95.57 -34.09 5.08 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 126.209 1.861 . . . . 0.0 114.016 176.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 46.2 mtm105 -138.32 73.64 1.45 Allowed 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.117 1.367 . . . . 0.0 109.615 169.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -165.11 140.38 5.26 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 127.77 2.428 . . . . 0.0 107.132 177.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -143.7 134.85 25.68 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 -167.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.4 t-160 -96.16 113.41 25.01 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 127.452 2.301 . . . . 0.0 110.341 -177.094 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 24.9 mmt -107.7 105.64 15.59 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.875 1.67 . . . . 0.0 109.782 179.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 8.2 t -116.48 125.27 51.72 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -169.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 21.4 t -87.93 88.8 2.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 N-CA-C 106.036 -1.838 . . . . 0.0 106.036 167.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 87.7 t -65.79 119.37 10.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 178.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 62.6 72.29 0.5 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.804 1.641 . . . . 0.0 111.308 -177.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -80.39 139.2 36.63 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.31 1.044 . . . . 0.0 112.088 178.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -112.07 170.05 8.42 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.976 1.71 . . . . 0.0 109.847 175.122 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 27.7 mtp180 -56.23 -34.98 66.84 Favored 'General case' 0 N--CA 1.48 1.066 0 O-C-N 120.86 -1.15 . . . . 0.0 113.436 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 23.7 p30 -63.96 -18.72 64.55 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 115.161 1.541 . . . . 0.0 115.161 175.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -80.56 -7.35 59.21 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.071 0.948 . . . . 0.0 112.656 174.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.4 m -61.85 134.89 57.27 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.086 -1.634 . . . . 0.0 111.11 171.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 159.96 -169.2 35.85 Favored Glycine 0 N--CA 1.471 0.979 0 C-N-CA 124.334 0.969 . . . . 0.0 113.315 -177.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 7.7 m -91.84 142.71 27.28 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.349 1.06 . . . . 0.0 110.319 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -138.98 155.82 47.71 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.539 1.536 . . . . 0.0 111.967 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -159.55 154.56 24.9 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.188 1.395 . . . . 0.0 112.877 178.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 3.3 t -107.91 167.01 10.28 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.091 1.756 . . . . 0.0 111.342 -173.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -159.76 168.79 35.63 Favored Glycine 0 CA--C 1.527 0.818 0 O-C-N 121.196 -0.94 . . . . 0.0 114.208 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -143.9 155.59 44.14 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.954 1.302 . . . . 0.0 112.152 174.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.8 tt -155.68 138.05 6.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 125.652 1.581 . . . . 0.0 110.888 178.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 4.8 m -64.51 161.52 17.14 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.458 1.103 . . . . 0.0 113.067 179.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 43.6 mt -74.24 -16.79 60.94 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 -178.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -69.37 150.11 97.16 Favored Pre-proline 0 CA--C 1.552 1.027 0 C-N-CA 124.619 1.167 . . . . 0.0 112.642 178.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.59 -20.93 35.01 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 123.106 2.537 . . . . 0.0 113.1 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -82.93 0.84 42.53 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 124.784 1.234 . . . . 0.0 113.964 178.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.68 168.52 13.0 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.167 1.387 . . . . 0.0 113.83 -176.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -147.28 156.29 42.8 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.859 1.663 . . . . 0.0 110.038 175.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 52.8 mt -81.57 127.03 39.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 123.082 0.553 . . . . 0.0 111.303 -171.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -95.09 114.49 26.3 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.251 1.82 . . . . 0.0 108.17 168.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -94.52 150.43 20.26 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.46 1.104 . . . . 0.0 111.866 -176.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 60.2 p -85.59 176.64 8.08 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.777 0.831 . . . . 0.0 112.498 169.05 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -69.7 159.88 32.68 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 121.676 -0.64 . . . . 0.0 109.988 165.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -93.44 159.85 15.07 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 -176.2 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -140.65 163.87 31.72 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.412 1.885 . . . . 0.0 111.827 178.161 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -105.28 138.88 40.78 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.105 1.362 . . . . 0.0 112.199 177.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 42.7 tp -108.52 131.37 54.9 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 126.343 1.857 . . . . 0.0 107.652 167.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 30.4 ttm180 -133.78 113.23 12.07 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 124.456 1.102 . . . . 0.0 109.532 -177.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 30.8 t -107.08 112.81 41.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 C-N-CA 124.394 1.078 . . . . 0.0 109.301 -175.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 72.7 p -93.44 160.43 14.81 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 126.622 1.969 . . . . 0.0 111.177 -176.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -62.5 142.91 57.71 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.857 0.863 . . . . 0.0 113.226 -172.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? . . . . . 0 N--CA 1.467 0.424 0 C-N-CA 124.473 1.109 . . . . 0.0 108.747 176.271 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 58.7 m . . . . . 0 N--CA 1.468 0.471 0 CA-C-O 121.222 0.534 . . . . 0.0 110.504 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 93.9 t80 -140.37 116.95 10.83 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 126.972 2.109 . . . . 0.0 108.214 174.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 38.1 m -140.83 160.95 56.64 Favored Pre-proline 0 N--CA 1.479 0.983 0 C-N-CA 124.545 1.138 . . . . 0.0 113.494 -168.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -68.53 156.88 88.86 Favored 'Cis proline' 0 C--N 1.355 0.897 0 CA-C-N 119.982 1.029 . . . . 0.0 111.751 -2.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.33 -28.07 64.72 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.802 0.841 . . . . 0.0 113.074 175.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -134.96 118.13 16.53 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 126.224 1.81 . . . . 0.0 109.187 173.157 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 51.7 tp -109.1 122.3 47.0 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.963 0.905 . . . . 0.0 109.761 171.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 32.2 t -106.84 122.92 61.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 124.132 0.973 . . . . 0.0 109.269 175.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.0 m -128.98 172.34 15.5 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 C-N-CA 125.04 1.336 . . . . 0.0 112.036 170.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 31.9 m -99.14 151.82 20.56 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.812 1.645 . . . . 0.0 110.693 177.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -47.19 122.07 4.25 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.998 1.319 . . . . 0.0 112.013 169.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 85.79 -1.85 87.95 Favored Glycine 0 CA--C 1.532 1.123 0 C-N-CA 125.736 1.636 . . . . 0.0 114.576 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 39.4 t0 -87.09 157.41 19.41 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.245 1.523 . . . . 0.0 111.393 175.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -84.08 150.62 25.45 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 121.903 0.859 . . . . 0.0 111.302 169.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -132.41 131.25 41.6 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.267 1.827 . . . . 0.0 110.03 -175.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 89.8 m -131.58 127.05 36.33 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.286 0.948 . . . . 0.0 111.82 179.167 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -100.11 159.54 15.02 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.002 1.721 . . . . 0.0 110.516 169.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 58.8 m -110.32 132.5 54.12 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.661 1.584 . . . . 0.0 109.88 174.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 39.5 t -116.73 144.1 44.86 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.991 1.716 . . . . 0.0 112.003 173.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 80.9 p -151.41 140.51 21.18 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.713 0.805 . . . . 0.0 112.115 171.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 . . . . . 0 CA--C 1.539 0.52 0 C-N-CA 126.49 1.916 . . . . 0.0 112.754 -174.726 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 54.2 p90 . . . . . 0 CA--C 1.538 0.481 0 CA-C-O 121.159 0.504 . . . . 0.0 111.999 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.3 t -96.01 135.76 29.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 125.594 1.557 . . . . 0.0 107.646 169.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -119.41 129.23 54.68 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.169 1.388 . . . . 0.0 108.841 -175.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -130.94 155.72 46.31 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.282 1.433 . . . . 0.0 113.144 -168.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 18.2 t90 -123.32 139.09 54.39 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.662 1.185 . . . . 0.0 112.257 179.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -133.07 147.66 52.18 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.214 1.406 . . . . 0.0 113.665 -173.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 51.2 ttp180 -110.28 141.11 43.73 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 127.419 2.288 . . . . 0.0 108.567 169.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 38.2 mtp -92.94 145.87 24.05 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.252 0.933 . . . . 0.0 112.155 178.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 24.0 p -90.85 165.54 21.87 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 123.626 0.77 . . . . 0.0 112.983 176.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.01 -29.04 89.59 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 123.589 2.859 . . . . 0.0 113.358 169.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 36.1 m -83.39 12.46 5.45 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.195 1.398 . . . . 0.0 112.89 174.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 63.4 t30 63.44 23.56 13.74 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.554 1.941 . . . . 0.0 113.353 178.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 46.4 mm-40 -89.7 -172.73 3.67 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.483 0.713 . . . . 0.0 109.798 170.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.4 p -137.58 143.5 41.55 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.347 1.459 . . . . 0.0 110.902 -176.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -123.73 129.77 51.61 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 126.572 1.949 . . . . 0.0 109.775 -178.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 74.3 tttt -86.6 119.66 27.08 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.604 1.162 . . . . 0.0 110.962 -171.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 65.9 mt -95.04 -51.07 4.81 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.696 1.199 . . . . 0.0 112.381 -168.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -167.37 171.72 10.34 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.321 1.448 . . . . 0.0 111.564 -174.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -150.09 158.36 44.08 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.104 1.362 . . . . 0.0 113.112 -169.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -137.26 136.94 21.33 Favored Pre-proline 0 CA--C 1.548 0.895 0 C-N-CA 125.687 1.595 . . . . 0.0 110.203 169.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo . . . . . 0 C--N 1.352 0.75 0 CA-C-N 120.279 1.136 . . . . 0.0 112.089 -8.566 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.3 ptp85 . . . . . 0 N--CA 1.478 0.957 0 N-CA-C 115.247 1.573 . . . . 0.0 115.247 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -111.88 140.48 46.5 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.714 1.606 . . . . 0.0 111.138 177.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 21.2 ttt-85 -144.4 143.72 31.06 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.832 0.853 . . . . 0.0 113.024 174.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 60.1 t -111.75 127.15 69.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 125.154 1.381 . . . . 0.0 107.704 167.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 76.3 m -130.55 129.55 42.96 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.09 0.956 . . . . 0.0 109.954 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -80.27 139.74 36.52 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.49 0.716 . . . . 0.0 110.978 176.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 30.6 mt -84.56 160.38 56.52 Favored Pre-proline 0 CA--C 1.545 0.766 0 C-N-CA 124.906 1.282 . . . . 0.0 111.669 176.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -62.32 -5.07 6.11 Favored 'Trans proline' 0 CA--C 1.543 0.931 0 C-N-CA 123.542 2.828 . . . . 0.0 114.704 174.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -62.64 -26.13 68.47 Favored 'General case' 0 CA--C 1.551 1.019 0 CA-C-N 119.569 1.077 . . . . 0.0 112.746 169.085 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 94.08 -17.06 59.56 Favored Glycine 0 N--CA 1.475 1.274 0 C-N-CA 125.59 1.567 . . . . 0.0 114.692 173.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 11.0 ptp180 -154.5 73.61 0.91 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.477 1.511 . . . . 0.0 109.839 169.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -166.44 140.6 4.19 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 128.652 2.781 . . . . 0.0 107.003 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -141.16 143.04 34.02 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 -166.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 17.1 m170 -105.55 132.84 51.21 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.524 1.529 . . . . 0.0 111.711 169.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -112.73 101.82 9.9 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 127.154 2.182 . . . . 0.0 109.298 -178.023 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 60.6 m -109.23 124.12 50.35 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 -169.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 37.2 t -93.53 125.99 46.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 126.278 1.831 . . . . 0.0 106.401 167.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 57.9 t -96.57 126.57 49.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 124.069 0.948 . . . . 0.0 109.408 171.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 67.1 ttt180 58.32 66.15 1.15 Allowed 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.778 1.631 . . . . 0.0 111.826 174.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -72.37 135.54 45.89 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 121.351 -0.843 . . . . 0.0 111.798 -178.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -111.49 164.86 12.52 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.93 1.692 . . . . 0.0 110.202 174.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 31.0 mtp180 -56.88 -32.99 66.41 Favored 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -171.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -64.97 -16.11 62.99 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 175.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 65.5 m-20 -79.73 -13.52 59.39 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 119.329 0.968 . . . . 0.0 112.8 173.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 20.4 m -63.45 129.23 39.36 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 120.868 -1.145 . . . . 0.0 111.566 177.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 158.8 -169.04 35.07 Favored Glycine 0 N--CA 1.47 0.908 0 C-N-CA 124.183 0.896 . . . . 0.0 113.286 -172.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.4 m -92.79 143.27 26.45 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.727 1.211 . . . . 0.0 111.267 -173.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -141.73 157.19 45.35 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.542 1.937 . . . . 0.0 111.267 -177.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -160.53 159.93 31.29 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.855 1.262 . . . . 0.0 113.617 177.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 39.1 t -103.07 149.47 24.56 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.911 1.685 . . . . 0.0 111.57 177.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -144.57 152.64 24.55 Favored Glycine 0 N--CA 1.471 1.015 0 C-N-CA 124.688 1.137 . . . . 0.0 113.182 175.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -132.39 154.63 49.62 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.629 1.171 . . . . 0.0 112.775 -176.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.3 tt -153.31 135.41 6.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 125.104 1.361 . . . . 0.0 110.995 177.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 12.6 m -67.98 158.28 33.17 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 121.099 -1.001 . . . . 0.0 112.498 177.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.7 -9.18 56.6 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 115.689 1.737 . . . . 0.0 115.689 -177.247 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -78.38 144.16 65.67 Favored Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 124.241 1.016 . . . . 0.0 112.281 -178.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -55.56 -29.04 68.01 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 123.748 2.965 . . . . 0.0 114.858 177.22 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -76.99 -5.99 50.85 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 115.056 1.502 . . . . 0.0 115.056 179.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.41 164.2 23.54 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.519 1.127 . . . . 0.0 113.365 -176.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -144.59 161.34 39.37 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.674 1.589 . . . . 0.0 110.295 173.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 56.8 mt -78.98 118.17 25.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 123.65 0.78 . . . . 0.0 111.158 -172.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 59.0 tttp -89.62 137.53 32.25 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.719 1.608 . . . . 0.0 109.214 168.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -115.29 152.75 32.18 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.448 1.099 . . . . 0.0 112.147 -173.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 78.3 p -97.59 172.55 7.65 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.077 1.351 . . . . 0.0 114.118 177.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 14.4 tp -69.99 119.8 14.75 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.144 1.378 . . . . 0.0 108.607 169.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 34.8 ptt-85 -71.35 163.93 26.72 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.101 1.36 . . . . 0.0 113.879 -175.041 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -142.64 169.65 17.18 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.807 2.043 . . . . 0.0 111.234 179.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -117.65 146.16 43.87 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 114.055 1.131 . . . . 0.0 114.055 174.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 66.8 tp -100.21 137.11 39.1 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 127.112 2.165 . . . . 0.0 108.875 169.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 29.3 ttm180 -132.02 117.56 18.55 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.293 1.437 . . . . 0.0 109.964 178.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 40.6 t -106.46 113.21 42.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 125.226 1.41 . . . . 0.0 108.904 178.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 73.8 p -95.01 160.69 14.46 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.824 1.65 . . . . 0.0 111.47 -178.349 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -57.74 144.9 36.46 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.732 1.213 . . . . 0.0 113.686 -173.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 69.7 ttp85 . . . . . 0 C--O 1.236 0.368 0 C-N-CA 124.278 1.031 . . . . 0.0 109.607 179.38 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.1 t . . . . . 0 N--CA 1.476 0.834 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -152.78 119.88 5.84 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.66 1.984 . . . . 0.0 110.658 175.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 94.9 p -140.93 164.19 37.72 Favored Pre-proline 0 CA--C 1.553 1.075 0 C-N-CA 125.446 1.498 . . . . 0.0 112.755 -172.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -70.24 170.65 59.52 Favored 'Cis proline' 0 C--N 1.355 0.873 0 CA-C-N 120.629 1.26 . . . . 0.0 112.396 -2.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.04 -32.94 74.42 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 171.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 49.1 tp -144.92 124.69 13.36 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.559 1.544 . . . . 0.0 109.586 171.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 62.1 tp -102.18 132.75 47.9 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.975 1.31 . . . . 0.0 108.888 169.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 24.7 t -112.65 127.29 69.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 124.072 0.949 . . . . 0.0 108.466 171.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 33.2 m -131.4 166.26 29.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 124.624 1.17 . . . . 0.0 111.708 175.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 25.4 m -90.5 148.91 22.43 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.258 1.023 . . . . 0.0 110.229 173.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -59.13 116.05 3.59 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.544 1.538 . . . . 0.0 111.357 176.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.17 5.47 65.7 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 126.385 1.945 . . . . 0.0 114.765 -174.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -92.05 154.78 18.54 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.355 1.578 . . . . 0.0 112.132 173.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -71.08 120.44 16.65 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.455 1.102 . . . . 0.0 110.753 173.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -97.9 128.09 44.27 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 117.867 -1.063 . . . . 0.0 110.076 174.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 28.4 m -132.74 132.08 41.89 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.169 0.988 . . . . 0.0 111.184 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -119.97 159.55 24.5 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 128.03 2.532 . . . . 0.0 109.982 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 49.7 m -105.44 124.44 49.55 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.332 1.053 . . . . 0.0 109.468 178.216 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 54.1 t -118.45 150.37 39.69 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.849 1.259 . . . . 0.0 110.908 169.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 27.4 t -152.9 146.49 25.04 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 120.734 -1.229 . . . . 0.0 111.763 169.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 48.3 m-85 . . . . . 0 CA--C 1.536 0.413 0 C-N-CA 127.981 2.513 . . . . 0.0 110.887 172.801 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 51.6 p90 . . . . . 0 CA--C 1.538 0.49 0 CA-C-O 121.107 0.48 . . . . 0.0 112.171 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 24.8 t -96.05 133.58 36.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 125.48 1.512 . . . . 0.0 107.853 172.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 14.6 tp -99.42 140.76 33.13 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.445 1.098 . . . . 0.0 110.088 172.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -132.32 151.98 51.61 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.466 1.906 . . . . 0.0 110.507 -179.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 14.1 t90 -125.9 146.15 49.96 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.091 0.956 . . . . 0.0 112.405 178.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -141.07 143.52 34.4 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 -169.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -103.96 142.05 35.1 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.05 1.34 . . . . 0.0 107.951 167.126 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 22.6 mtp -88.49 145.91 25.48 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 118.897 0.771 . . . . 0.0 112.659 179.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 64.5 m -96.1 152.26 38.76 Favored Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 125.134 1.374 . . . . 0.0 110.923 171.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -67.52 -12.62 36.32 Favored 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 123.632 2.888 . . . . 0.0 113.621 -179.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 29.1 p -76.96 4.04 10.84 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 126.255 1.822 . . . . 0.0 113.633 169.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 59.8 t30 67.04 41.51 2.63 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.88 2.072 . . . . 0.0 111.347 -174.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 21.5 mm-40 -121.46 -172.69 2.47 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.59 1.956 . . . . 0.0 109.594 176.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 12.5 p -146.3 152.56 39.34 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.102 1.361 . . . . 0.0 111.404 -172.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -127.04 132.37 50.72 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.988 1.315 . . . . 0.0 110.919 173.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -78.75 124.98 28.76 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.484 1.114 . . . . 0.0 111.21 -175.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 74.0 mt -100.66 -44.61 5.77 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.341 1.456 . . . . 0.0 112.829 -169.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -166.21 170.92 12.79 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.165 1.786 . . . . 0.0 110.638 -171.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -155.93 163.43 39.76 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.661 1.184 . . . . 0.0 112.796 -177.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -141.8 121.31 8.1 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 125.269 1.428 . . . . 0.0 110.035 169.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo . . . . . 0 C--N 1.352 0.736 0 CA-C-N 120.378 1.171 . . . . 0.0 112.984 -7.287 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 43.7 mtm180 . . . . . 0 CA--C 1.532 0.286 0 N-CA-C 113.803 1.038 . . . . 0.0 113.803 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -65.03 129.46 39.79 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.356 1.462 . . . . 0.0 110.813 169.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 59.0 ttp85 -144.45 154.0 42.48 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.733 1.613 . . . . 0.0 112.102 -170.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 17.7 t -117.54 138.02 49.57 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 125.994 1.718 . . . . 0.0 110.166 173.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 3.1 m -114.54 128.38 56.3 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.237 1.415 . . . . 0.0 110.153 171.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 28.0 tp60 -84.84 122.38 29.07 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.531 1.132 . . . . 0.0 108.222 168.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 24.6 mt -84.56 154.96 62.52 Favored Pre-proline 0 N--CA 1.472 0.668 0 CA-C-O 118.766 -0.635 . . . . 0.0 110.751 176.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -65.95 -4.93 10.99 Favored 'Trans proline' 0 CA--C 1.54 0.777 0 C-N-CA 123.571 2.847 . . . . 0.0 113.926 176.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -64.95 -26.12 68.17 Favored 'General case' 0 CA--C 1.55 0.96 0 CA-C-N 119.434 1.016 . . . . 0.0 112.182 169.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 85.44 -34.09 3.34 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 126.592 2.044 . . . . 0.0 113.867 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 17.2 mtp180 -125.88 73.51 1.35 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.771 1.228 . . . . 0.0 109.197 174.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 174.12 142.2 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 128.757 2.823 . . . . 0.0 109.057 -174.701 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 84.6 m-85 -149.79 151.46 33.6 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.553 1.141 . . . . 0.0 112.66 -167.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 5.8 m-70 -116.34 114.48 24.37 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.512 0.725 . . . . 0.0 111.344 169.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 24.6 mmt -84.23 144.04 29.19 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.293 1.037 . . . . 0.0 109.371 172.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 72.3 p -151.36 151.77 32.21 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 115.565 1.691 . . . . 0.0 115.565 -179.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 16.0 t -109.69 116.2 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 125.526 1.531 . . . . 0.0 107.466 169.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 96.9 t -70.86 112.52 5.78 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 170.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 80.5 mtt85 57.49 77.09 0.29 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.392 1.477 . . . . 0.0 111.317 178.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.29 132.88 45.56 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.595 1.158 . . . . 0.0 111.325 -179.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 8.6 mpt_? -105.84 163.26 12.86 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.767 1.627 . . . . 0.0 109.989 176.143 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 73.9 mtm180 -57.52 -20.23 30.12 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 175.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -54.59 -29.95 53.06 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.977 1.711 . . . . 0.0 113.668 167.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 36.4 m-20 -93.21 -12.74 29.52 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.059 1.344 . . . . 0.0 114.551 -168.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 49.5 m -59.42 139.46 57.06 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 119.602 1.092 . . . . 0.0 112.768 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 149.35 -163.83 29.27 Favored Glycine 0 N--CA 1.472 1.053 0 C-N-CA 124.131 0.872 . . . . 0.0 113.435 -178.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.7 m -92.64 147.53 22.8 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.006 1.322 . . . . 0.0 110.702 -178.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -142.29 158.75 43.37 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.641 1.976 . . . . 0.0 111.253 -176.126 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.5 pp -154.36 158.84 40.69 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.914 1.286 . . . . 0.0 112.112 172.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 9.3 t -108.45 161.48 15.0 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.071 1.748 . . . . 0.0 110.291 177.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -157.46 155.3 26.29 Favored Glycine 0 N--CA 1.47 0.943 0 O-C-N 120.945 -1.097 . . . . 0.0 114.36 176.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -130.58 154.2 48.09 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.433 1.093 . . . . 0.0 112.818 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.6 tt -148.21 135.3 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 125.428 1.491 . . . . 0.0 110.528 176.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 23.3 m -67.04 161.1 25.16 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -179.285 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.26 -17.5 64.55 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 -175.657 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -78.51 148.9 74.33 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 124.744 1.218 . . . . 0.0 112.473 -177.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -67.9 -23.08 41.5 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.108 2.539 . . . . 0.0 113.069 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.8 pttp -80.31 -1.76 42.36 Favored 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 114.654 1.353 . . . . 0.0 114.654 176.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -67.83 164.32 19.89 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.731 1.212 . . . . 0.0 113.135 -179.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -137.05 155.77 49.24 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.771 1.628 . . . . 0.0 109.394 176.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 50.8 mt -79.24 125.25 38.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 123.343 0.657 . . . . 0.0 110.673 -176.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -95.69 120.91 36.79 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.899 1.68 . . . . 0.0 109.414 169.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -91.57 151.81 20.57 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.661 1.185 . . . . 0.0 112.223 -177.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 56.0 p -85.99 178.96 7.09 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.347 1.059 . . . . 0.0 112.426 169.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -71.67 159.33 34.59 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.523 -0.735 . . . . 0.0 110.688 166.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 70.3 mtt180 -75.41 143.43 42.73 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 123.991 0.916 . . . . 0.0 112.172 -178.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -124.17 166.46 15.79 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.749 2.02 . . . . 0.0 110.105 169.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -126.66 152.76 46.29 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.579 1.151 . . . . 0.0 111.707 177.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 64.7 tp -125.35 132.9 52.75 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 126.181 1.792 . . . . 0.0 109.4 172.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 53.9 ttp180 -123.0 117.19 24.91 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.948 1.299 . . . . 0.0 109.875 169.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 40.8 t -96.29 120.37 45.57 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 169.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 82.8 p -99.07 149.29 23.17 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.752 1.621 . . . . 0.0 109.932 177.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 38.8 mp0 -53.31 149.01 7.83 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.8 1.24 . . . . 0.0 113.402 -174.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 . . . . . 0 C--O 1.237 0.397 0 C-N-CA 124.543 1.137 . . . . 0.0 109.667 -178.838 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 17.0 p . . . . . 0 N--CA 1.473 0.704 0 CA-C-O 120.656 0.265 . . . . 0.0 111.185 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -120.85 140.09 52.25 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.97 1.308 . . . . 0.0 110.527 -174.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 16.9 m -140.91 156.76 68.47 Favored Pre-proline 0 CA--C 1.547 0.855 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 178.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -71.1 155.13 96.94 Favored 'Cis proline' 0 C--N 1.35 0.655 0 N-CA-C 110.367 -0.666 . . . . 0.0 110.367 -12.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.68 -30.19 67.18 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 173.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 46.0 tp -138.53 118.86 13.67 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.645 1.578 . . . . 0.0 109.095 170.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.4 tp -101.19 126.89 47.95 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.241 1.416 . . . . 0.0 109.229 172.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.6 t -109.79 124.54 66.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 171.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.8 m -128.09 174.28 11.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 C-N-CA 124.814 1.245 . . . . 0.0 111.284 172.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 33.8 m -104.34 151.85 22.96 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.657 1.583 . . . . 0.0 110.281 174.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -45.25 122.87 3.66 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.082 1.753 . . . . 0.0 112.509 171.728 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.27 0.42 89.48 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 125.902 1.715 . . . . 0.0 115.126 -179.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -88.08 155.77 19.63 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 119.768 1.784 . . . . 0.0 112.629 177.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -76.14 121.83 23.42 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.839 1.256 . . . . 0.0 110.771 173.13 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -101.4 131.45 47.48 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.112 0.965 . . . . 0.0 110.688 175.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 21.3 m -132.76 124.96 29.07 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.822 0.849 . . . . 0.0 111.531 -178.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -104.96 159.46 15.8 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 126.041 1.736 . . . . 0.0 111.102 170.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 32.2 m -120.52 138.59 53.76 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.615 1.566 . . . . 0.0 110.052 177.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 74.4 m -128.6 137.5 51.73 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.023 1.329 . . . . 0.0 110.938 169.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 47.6 p -124.89 140.9 52.51 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.39 0.676 . . . . 0.0 109.673 170.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 . . . . . 0 N--CA 1.466 0.374 0 N-CA-C 113.988 1.107 . . . . 0.0 113.988 -169.053 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 42.7 p90 . . . . . 0 CA--C 1.539 0.53 0 CA-C-O 121.137 0.494 . . . . 0.0 111.743 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 40.7 t -95.85 125.5 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 N-CA-C 106.487 -1.671 . . . . 0.0 106.487 169.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 37.6 tp -99.38 139.33 35.19 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 123.054 0.541 . . . . 0.0 109.647 174.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -128.16 137.12 51.94 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.544 1.538 . . . . 0.0 109.997 -176.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 68.9 t-105 -98.19 134.93 40.56 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.68 1.192 . . . . 0.0 110.699 173.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 90.5 m-85 -124.2 143.42 50.52 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.913 1.285 . . . . 0.0 112.805 -178.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 56.8 ttp85 -95.83 142.96 27.48 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 126.542 1.937 . . . . 0.0 107.874 167.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 33.1 mtp -91.61 144.89 25.07 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 118.826 0.739 . . . . 0.0 112.206 172.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 58.8 m -108.96 149.49 39.67 Favored Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 125.559 1.543 . . . . 0.0 110.85 171.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -69.01 -14.88 39.32 Favored 'Trans proline' 0 C--N 1.353 0.784 0 C-N-CA 123.879 3.053 . . . . 0.0 114.482 -171.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 6.1 t -76.91 7.92 4.31 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 119.098 0.863 . . . . 0.0 113.153 170.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 34.3 m-80 75.6 36.79 0.45 Allowed 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 127.896 2.479 . . . . 0.0 112.039 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -115.84 172.61 7.03 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.176 1.39 . . . . 0.0 111.007 179.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.8 p -132.62 152.49 51.63 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 125.842 1.657 . . . . 0.0 111.505 -178.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -138.51 125.89 21.77 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.539 1.536 . . . . 0.0 110.927 -177.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -77.64 125.33 29.17 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.138 0.975 . . . . 0.0 111.218 -176.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 25.4 mt -102.09 -43.35 5.78 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.894 0.878 . . . . 0.0 112.944 -179.016 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -157.46 168.13 28.22 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.377 1.471 . . . . 0.0 111.455 -172.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.66 167.86 27.41 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.44 1.096 . . . . 0.0 112.862 -178.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -142.22 126.16 9.84 Favored Pre-proline 0 CA--C 1.543 0.674 0 C-N-CA 124.661 1.185 . . . . 0.0 110.33 169.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo . . . . . 0 C--N 1.351 0.677 0 CA-C-N 119.355 0.805 . . . . 0.0 112.725 -10.649 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 5.2 ptm180 . . . . . 0 N--CA 1.47 0.535 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -97.8 125.53 42.69 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.898 1.279 . . . . 0.0 109.33 172.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -142.94 152.53 42.11 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.472 1.109 . . . . 0.0 111.945 -169.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 49.0 t -126.6 139.85 50.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.116 0 C-N-CA 124.856 1.262 . . . . 0.0 111.021 176.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 97.4 m -123.38 128.89 50.51 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.538 1.535 . . . . 0.0 109.509 170.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 37.2 tt0 -85.9 137.74 32.53 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.887 0.875 . . . . 0.0 110.149 170.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 34.3 mt -91.1 157.31 43.14 Favored Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 124.357 1.063 . . . . 0.0 111.894 -179.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -66.75 -3.85 10.08 Favored 'Trans proline' 0 CA--C 1.542 0.91 0 C-N-CA 123.664 2.91 . . . . 0.0 114.028 174.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -66.59 -13.66 61.37 Favored 'General case' 0 CA--C 1.555 1.147 0 CA-C-N 119.378 0.99 . . . . 0.0 112.951 170.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 92.32 -24.57 21.85 Favored Glycine 0 N--CA 1.476 1.307 0 C-N-CA 125.916 1.722 . . . . 0.0 115.716 168.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 11.5 ptp180 -154.5 73.64 0.92 Allowed 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.534 1.534 . . . . 0.0 109.695 172.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -168.89 137.0 2.01 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 128.074 2.55 . . . . 0.0 107.273 -171.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 55.1 m-85 -148.78 146.58 28.09 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -167.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 4.8 m-70 -106.03 132.5 52.04 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.283 1.433 . . . . 0.0 111.116 168.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 2.6 mpp? -112.1 120.31 41.4 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 126.361 1.864 . . . . 0.0 109.365 177.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 36.0 m -116.22 130.89 57.01 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.322 1.049 . . . . 0.0 112.211 -169.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 58.1 t -105.66 110.79 32.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 125.775 1.63 . . . . 0.0 107.13 168.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 96.8 t -76.29 123.44 32.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.495 1.118 . . . . 0.0 109.55 178.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 53.63 73.43 0.38 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.053 1.741 . . . . 0.0 111.574 177.047 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.87 132.26 44.15 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.195 0.998 . . . . 0.0 111.269 -179.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -106.94 161.65 14.53 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 126.198 1.799 . . . . 0.0 110.104 177.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -50.68 -35.79 32.69 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 119.292 0.951 . . . . 0.0 113.377 -178.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -62.88 -21.1 65.74 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 125.564 1.546 . . . . 0.0 115.003 176.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -76.4 -11.87 59.96 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 119.69 1.132 . . . . 0.0 113.116 177.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.9 m -62.93 131.08 47.5 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 120.617 -1.302 . . . . 0.0 112.349 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 156.99 -168.77 34.04 Favored Glycine 0 N--CA 1.472 1.055 0 C-N-CA 124.381 0.991 . . . . 0.0 113.703 -173.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.2 m -95.8 142.48 28.03 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.623 1.169 . . . . 0.0 111.219 -175.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -146.1 160.91 41.27 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.149 1.78 . . . . 0.0 111.071 -177.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -161.77 169.07 22.08 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 120.871 -1.143 . . . . 0.0 113.99 -175.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 6.4 m -107.06 148.26 28.96 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.178 1.391 . . . . 0.0 112.356 175.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -145.66 135.77 6.1 Favored Glycine 0 N--CA 1.469 0.859 0 C-N-CA 125.02 1.295 . . . . 0.0 111.523 169.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -113.96 157.28 22.65 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.008 0.923 . . . . 0.0 112.82 -176.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 19.7 tt -143.41 131.49 18.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 125.141 1.377 . . . . 0.0 110.226 172.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 15.3 m -68.27 161.61 26.88 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.179 1.392 . . . . 0.0 114.152 -171.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.9 -10.92 32.36 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 116.119 1.896 . . . . 0.0 116.119 -176.576 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -81.47 149.83 65.76 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.766 1.227 . . . . 0.0 112.427 -178.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -68.09 -21.5 42.63 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 123.038 2.492 . . . . 0.0 112.699 175.59 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 1.9 tppp? -81.52 -4.07 54.93 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 125.217 1.407 . . . . 0.0 113.66 177.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.5 164.69 13.5 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.813 1.245 . . . . 0.0 113.986 -175.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 38.0 tt0 -152.44 141.25 21.02 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.228 1.811 . . . . 0.0 108.437 -178.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 60.7 mt -59.62 140.5 17.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 124.189 0.996 . . . . 0.0 112.227 -172.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 32.5 mmtm -125.74 124.33 40.8 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.743 1.617 . . . . 0.0 110.306 169.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -147.74 141.92 26.12 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.119 1.767 . . . . 0.0 110.93 -174.417 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 8.4 t -173.35 156.65 3.14 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 126.259 1.824 . . . . 0.0 109.982 -179.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.1 mp 68.94 173.88 0.29 Allowed 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 127.293 2.237 . . . . 0.0 111.209 -169.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -159.63 168.22 26.57 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.611 1.564 . . . . 0.0 112.49 173.6 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -128.93 161.62 29.46 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 126.946 2.098 . . . . 0.0 110.892 173.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -116.53 139.28 50.66 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.802 1.241 . . . . 0.0 111.081 -178.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 54.4 tp -108.82 132.8 53.65 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 125.684 1.593 . . . . 0.0 109.929 171.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 66.2 ttt180 -122.49 119.38 30.75 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.901 1.68 . . . . 0.0 109.153 169.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 38.6 t -104.64 115.27 46.22 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 124.211 1.004 . . . . 0.0 108.557 171.141 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 80.8 p -87.58 153.3 21.5 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.004 1.721 . . . . 0.0 110.144 177.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 4.2 pm0 -66.52 154.58 39.98 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.696 0.798 . . . . 0.0 112.884 -178.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 19.8 tpt180 . . . . . 0 N--CA 1.466 0.37 0 C-N-CA 123.99 0.916 . . . . 0.0 109.646 -173.152 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.5 t . . . . . 0 N--CA 1.467 0.417 0 CA-C-O 121.723 0.773 . . . . 0.0 112.191 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 82.8 t80 -145.45 118.06 8.6 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 127.419 2.288 . . . . 0.0 108.732 -175.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 97.8 p -140.84 161.56 53.38 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 124.808 1.243 . . . . 0.0 113.645 -168.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -67.67 161.53 78.85 Favored 'Cis proline' 0 C--N 1.355 0.886 0 CA-C-N 120.041 1.051 . . . . 0.0 111.707 -4.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.64 -24.75 67.76 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 176.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 13.5 tp -139.71 121.04 14.94 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 126.015 1.726 . . . . 0.0 108.487 171.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 61.3 tp -109.67 121.35 45.01 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.38 1.072 . . . . 0.0 108.591 168.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 14.3 p -109.95 126.46 67.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 123.867 0.867 . . . . 0.0 109.779 171.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 27.0 m -130.77 165.77 30.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 125.006 1.323 . . . . 0.0 111.964 176.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.3 m -89.44 147.8 23.81 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.748 1.219 . . . . 0.0 110.489 172.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -52.85 125.99 18.76 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.483 1.113 . . . . 0.0 111.393 174.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 91.06 -2.44 79.25 Favored Glycine 0 CA--C 1.534 1.231 0 C-N-CA 125.305 1.431 . . . . 0.0 114.75 -176.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -87.04 157.19 19.48 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 119.704 1.752 . . . . 0.0 112.275 175.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 53.6 m-20 -90.24 104.45 17.02 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.2 1.0 . . . . 0.0 110.234 178.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -90.27 111.87 23.21 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.843 0.857 . . . . 0.0 111.583 -171.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 25.8 m -113.61 125.13 53.83 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 118.716 0.689 . . . . 0.0 112.318 -173.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -101.89 159.59 15.21 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 127.094 2.158 . . . . 0.0 110.229 169.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.0 m -112.39 132.89 54.78 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.011 1.324 . . . . 0.0 109.847 174.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 43.1 t -117.51 144.4 45.11 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.765 1.626 . . . . 0.0 111.336 171.451 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 46.8 t -147.08 141.51 26.41 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.361 -0.837 . . . . 0.0 111.756 173.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 . . . . . 0 N--CA 1.467 0.395 0 C-N-CA 126.529 1.932 . . . . 0.0 113.948 -176.472 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 53.2 p90 . . . . . 0 CA--C 1.537 0.464 0 CA-C-O 121.028 0.442 . . . . 0.0 111.48 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 49.1 t -96.07 128.7 47.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 C-N-CA 125.224 1.409 . . . . 0.0 107.68 173.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -112.95 122.02 46.38 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.433 1.493 . . . . 0.0 109.006 -175.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 11.4 m-80 -122.57 158.53 29.71 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.369 1.467 . . . . 0.0 112.788 -168.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 10.0 t90 -124.18 137.69 54.51 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 125.311 1.444 . . . . 0.0 112.068 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -132.99 141.09 48.11 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.786 1.234 . . . . 0.0 113.077 -176.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.5 ttt-85 -101.14 140.93 34.74 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.393 1.477 . . . . 0.0 108.258 168.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 29.8 mtp -91.98 145.92 24.15 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 119.04 0.836 . . . . 0.0 111.978 178.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 67.4 m -96.64 158.95 32.8 Favored Pre-proline 0 CA--C 1.549 0.906 0 C-N-CA 124.369 1.068 . . . . 0.0 112.064 174.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -56.57 -34.26 94.9 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 123.944 3.096 . . . . 0.0 113.654 174.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 9.6 m -77.01 18.03 0.4 Allowed 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.617 1.567 . . . . 0.0 113.529 175.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . 0.318 13.6 p30 58.01 21.04 7.37 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 128.263 2.625 . . . . 0.0 115.623 -176.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 18.7 mm100 -82.98 -178.06 6.99 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.052 0.941 . . . . 0.0 110.556 169.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -148.65 141.99 25.18 Favored 'General case' 0 CA--C 1.518 -0.271 0 C-N-CA 127.185 2.194 . . . . 0.0 108.546 -171.399 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -127.27 120.06 27.77 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 125.846 1.659 . . . . 0.0 109.359 -172.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 57.8 tttm -76.92 117.02 18.1 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.888 1.275 . . . . 0.0 110.868 -176.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 37.2 mt -94.45 -50.04 5.4 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.834 1.254 . . . . 0.0 112.966 -168.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -171.23 170.46 6.03 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.74 2.016 . . . . 0.0 110.33 -169.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.69 165.53 32.41 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.588 1.155 . . . . 0.0 112.963 -176.46 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -129.93 130.21 23.12 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 125.95 1.7 . . . . 0.0 109.268 169.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo . . . . . 0 C--N 1.351 0.67 0 CA-C-N 120.359 1.164 . . . . 0.0 112.734 -7.026 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 89.6 mtt180 . . . . . 0 N--CA 1.471 0.597 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -85.69 122.03 29.21 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.477 1.111 . . . . 0.0 111.966 -169.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -140.32 140.55 35.65 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.967 1.307 . . . . 0.0 110.539 -173.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.5 t -126.52 130.87 71.77 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 124.922 1.289 . . . . 0.0 110.01 -177.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 89.7 m -130.17 127.99 40.84 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.933 1.293 . . . . 0.0 110.427 -179.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -79.97 140.11 36.76 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.114 0.965 . . . . 0.0 110.997 173.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 27.1 mt -97.63 159.32 31.33 Favored Pre-proline 0 CA--C 1.546 0.827 0 C-N-CA 125.056 1.342 . . . . 0.0 111.487 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -67.0 -3.68 10.11 Favored 'Trans proline' 0 CA--C 1.543 0.944 0 C-N-CA 123.681 2.921 . . . . 0.0 114.351 175.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -69.05 -8.86 49.06 Favored 'General case' 0 CA--C 1.557 1.243 0 CA-C-N 119.364 0.983 . . . . 0.0 113.277 172.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 90.01 -34.08 4.23 Favored Glycine 0 N--CA 1.476 1.351 0 C-N-CA 126.439 1.971 . . . . 0.0 115.971 168.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 78.9 mtt85 -140.06 73.61 1.43 Allowed 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.862 1.265 . . . . 0.0 109.11 169.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -165.79 136.06 3.54 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 125.649 1.58 . . . . 0.0 108.577 -171.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -146.89 131.46 17.77 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.96 0.904 . . . . 0.0 111.734 -167.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 5.0 m-70 -94.53 133.87 37.69 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.743 0.817 . . . . 0.0 110.7 169.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 32.1 mtt -123.44 105.31 9.69 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 126.387 1.875 . . . . 0.0 109.242 -174.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 7.2 t -112.83 128.91 56.57 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -169.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 15.2 t -92.86 90.09 2.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 106.588 -1.634 . . . . 0.0 106.588 168.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 72.5 t -64.84 131.34 30.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 123.451 0.7 . . . . 0.0 109.236 177.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 3.5 tpp180 62.81 45.78 5.5 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.786 1.235 . . . . 0.0 112.136 173.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.33 138.12 58.42 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.583 -0.698 . . . . 0.0 112.724 -169.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 51.8 mmm-85 -116.42 163.76 15.57 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 126.178 1.791 . . . . 0.0 110.39 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 33.2 mtm105 -55.39 -25.42 35.5 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 179.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -71.72 -18.82 62.12 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 174.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -79.72 -27.37 40.62 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 119.736 1.153 . . . . 0.0 112.329 177.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 50.8 m -49.47 139.79 11.53 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.822 1.249 . . . . 0.0 113.152 179.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 147.22 -167.15 28.47 Favored Glycine 0 N--CA 1.472 1.055 0 C-N-CA 124.535 1.064 . . . . 0.0 113.089 -174.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.7 m -91.93 148.17 22.41 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.996 1.318 . . . . 0.0 110.833 -177.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 65.7 m-85 -147.41 157.95 43.78 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.907 1.683 . . . . 0.0 112.083 -174.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -158.4 159.27 35.58 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.993 1.317 . . . . 0.0 113.492 175.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 49.7 t -104.03 148.6 26.03 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.257 1.823 . . . . 0.0 111.255 178.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -151.77 136.44 5.48 Favored Glycine 0 N--CA 1.474 1.179 0 C-N-CA 123.743 0.687 . . . . 0.0 114.308 177.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -113.84 155.68 25.27 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.74 1.216 . . . . 0.0 113.046 -176.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 18.5 tt -146.51 132.79 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 125.316 1.446 . . . . 0.0 110.436 172.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 16.4 m -72.46 161.13 31.23 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.529 1.131 . . . . 0.0 112.954 -178.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.58 -10.13 49.09 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 115.946 1.832 . . . . 0.0 115.946 -178.515 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -71.52 147.55 92.53 Favored Pre-proline 0 CA--C 1.549 0.926 0 C-N-CA 124.241 1.016 . . . . 0.0 112.303 -178.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -67.57 -21.89 45.34 Favored 'Trans proline' 0 CA--C 1.538 0.725 0 C-N-CA 122.982 2.455 . . . . 0.0 112.807 177.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -85.99 -0.82 56.45 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 124.874 1.269 . . . . 0.0 113.893 176.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.9 157.17 31.33 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.245 1.018 . . . . 0.0 113.094 -177.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 84.6 mt-30 -138.0 158.62 43.96 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.118 1.767 . . . . 0.0 108.916 175.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 57.9 mt -78.23 118.27 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 121.745 -0.597 . . . . 0.0 110.578 -175.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 3.8 ttmp? -94.19 131.43 39.76 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.272 1.429 . . . . 0.0 109.12 169.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -114.51 149.74 35.94 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.18 0.992 . . . . 0.0 112.504 -170.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 51.7 m -88.37 164.97 15.27 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.295 1.438 . . . . 0.0 113.132 174.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -66.7 139.52 57.84 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.566 0.746 . . . . 0.0 109.408 168.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.55 166.62 23.29 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 -173.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -142.28 169.6 17.27 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 127.227 2.211 . . . . 0.0 110.668 172.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -116.74 144.69 44.15 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 174.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 66.9 tp -102.67 135.91 43.44 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 127.141 2.176 . . . . 0.0 109.224 169.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 35.3 ttm180 -131.6 108.54 9.6 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.339 1.456 . . . . 0.0 109.503 -179.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 35.9 t -99.82 115.22 40.35 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 124.198 0.999 . . . . 0.0 109.064 176.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 82.8 p -97.03 154.88 17.05 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.891 1.676 . . . . 0.0 110.664 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -63.09 142.49 58.36 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.304 0.642 . . . . 0.0 112.455 -176.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 48.7 ttt85 . . . . . 0 N--CA 1.467 0.407 0 C-N-CA 123.87 0.868 . . . . 0.0 110.826 -179.087 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.1 t . . . . . 0 C--O 1.237 0.434 0 CA-C-O 121.276 0.56 . . . . 0.0 111.055 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -120.7 114.27 21.42 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 126.079 1.752 . . . . 0.0 106.819 171.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 67.6 m -130.94 151.99 79.89 Favored Pre-proline 0 N--CA 1.475 0.811 0 N-CA-C 114.144 1.165 . . . . 0.0 114.144 -169.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -68.55 152.52 89.0 Favored 'Cis proline' 0 C--N 1.353 0.779 0 CA-C-N 118.79 0.604 . . . . 0.0 111.257 -4.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -55.94 -28.63 57.76 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 176.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 45.1 tp -137.16 114.46 10.88 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.46 1.504 . . . . 0.0 108.302 168.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 44.7 tp -96.74 126.62 42.03 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.96 1.304 . . . . 0.0 109.187 173.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.7 t -111.77 122.84 66.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 124.142 0.977 . . . . 0.0 108.472 172.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 33.6 m -126.54 167.98 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 124.347 1.059 . . . . 0.0 111.997 174.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 22.7 m -91.12 146.64 23.67 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.779 1.232 . . . . 0.0 110.128 172.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -52.41 120.15 5.25 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.469 1.108 . . . . 0.0 111.78 174.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 97.86 -1.58 59.71 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 126.083 1.801 . . . . 0.0 114.804 -177.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -89.62 155.06 19.49 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 119.556 1.678 . . . . 0.0 112.556 178.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 66.8 m-20 -83.21 106.08 14.71 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.012 0.925 . . . . 0.0 110.182 177.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -89.66 111.9 22.99 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.841 0.856 . . . . 0.0 110.872 -176.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 33.8 m -120.08 125.53 48.51 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.961 0.904 . . . . 0.0 111.496 -175.289 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -96.98 146.92 24.51 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 126.05 1.74 . . . . 0.0 110.684 170.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 88.4 m -94.17 123.92 37.86 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.003 1.321 . . . . 0.0 108.081 169.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 37.2 t -122.74 122.6 39.13 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.878 1.671 . . . . 0.0 109.774 -176.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 42.4 t -143.74 127.5 17.2 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 121.45 -0.781 . . . . 0.0 111.067 -169.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 33.6 p90 . . . . . 0 CA--C 1.537 0.448 0 C-N-CA 125.472 1.509 . . . . 0.0 111.653 169.861 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 32.5 p90 . . . . . 0 CA--C 1.537 0.473 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 91.4 t -96.19 134.22 34.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 C-N-CA 126.216 1.806 . . . . 0.0 108.616 169.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -100.39 128.31 46.49 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.246 1.019 . . . . 0.0 108.427 168.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 28.3 m120 -120.48 157.14 30.03 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.513 1.925 . . . . 0.0 111.423 -176.076 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 17.1 t90 -135.03 143.76 46.92 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.32 1.048 . . . . 0.0 112.821 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -141.4 148.51 39.69 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.907 1.283 . . . . 0.0 114.097 -169.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 59.1 ttt85 -104.45 143.21 33.32 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.453 1.501 . . . . 0.0 108.172 167.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 33.8 mtp -86.49 145.07 26.96 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.354 0.979 . . . . 0.0 112.388 174.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 74.1 m -107.4 152.19 41.19 Favored Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 125.612 1.565 . . . . 0.0 111.478 177.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -68.57 -17.35 43.23 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 124.102 3.201 . . . . 0.0 113.608 -175.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.3 m -76.92 9.09 3.14 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.849 1.26 . . . . 0.0 113.005 171.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 58.9 t30 69.63 46.51 0.71 Allowed 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 127.402 2.281 . . . . 0.0 111.901 178.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -137.72 -172.61 3.28 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.077 1.351 . . . . 0.0 110.922 176.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.2 p -138.05 151.05 47.48 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 125.847 1.659 . . . . 0.0 110.474 -172.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -127.76 131.8 49.62 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 124.878 1.271 . . . . 0.0 111.224 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -78.44 118.84 20.98 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.316 1.447 . . . . 0.0 111.404 -172.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 86.1 mt -97.41 -51.12 4.27 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.773 1.229 . . . . 0.0 112.278 -170.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -168.51 171.32 9.04 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.748 1.619 . . . . 0.0 109.858 -174.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.51 163.06 35.54 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.803 1.241 . . . . 0.0 111.351 -176.276 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 38.9 t80 -138.07 116.22 9.54 Favored Pre-proline 0 CA--C 1.546 0.818 0 C-N-CA 124.032 0.933 . . . . 0.0 110.543 169.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo . . . . . 0 CA--C 1.539 0.765 0 CA-C-N 119.286 0.781 . . . . 0.0 111.379 -8.553 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 66.2 mtt85 . . . . . 0 N--CA 1.469 0.505 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -83.08 132.37 35.12 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 -165.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -143.82 141.31 30.31 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.384 1.474 . . . . 0.0 111.746 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 89.8 t -123.72 129.1 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 C-N-CA 125.552 1.541 . . . . 0.0 109.065 170.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 89.0 m -129.86 131.44 46.1 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.155 1.382 . . . . 0.0 110.074 -179.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -82.93 135.92 34.74 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.947 0.899 . . . . 0.0 110.359 173.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 33.2 mt -88.31 163.02 38.25 Favored Pre-proline 0 CA--C 1.547 0.842 0 C-N-CA 123.569 0.748 . . . . 0.0 111.987 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.74 -22.93 38.83 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 123.996 3.131 . . . . 0.0 114.009 170.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 58.5 t30 -65.14 -12.19 48.3 Favored 'General case' 0 CA--C 1.555 1.173 0 C-N-CA 124.26 1.024 . . . . 0.0 113.445 175.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 78.25 -34.11 1.76 Allowed Glycine 0 N--CA 1.476 1.351 0 C-N-CA 127.677 2.56 . . . . 0.0 116.352 168.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 2.5 ppt_? -130.13 73.47 1.53 Allowed 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 123.512 1.625 . . . . 0.0 108.32 171.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 11.1 t0 179.76 136.91 0.11 Allowed 'General case' 0 C--O 1.238 0.485 0 C-N-CA 128.515 2.726 . . . . 0.0 108.415 -169.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -145.85 148.51 32.95 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 124.222 1.009 . . . . 0.0 112.35 -168.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 14.2 m170 -105.68 123.59 48.17 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.079 1.352 . . . . 0.0 111.099 169.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -110.96 111.3 22.33 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 126.813 2.045 . . . . 0.0 108.01 -178.106 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 8.4 t -123.7 134.3 53.73 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 115.317 1.599 . . . . 0.0 115.317 -168.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 25.7 t -99.33 93.57 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 126.42 1.888 . . . . 0.0 106.153 167.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 98.0 t -66.9 127.23 28.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 124.882 1.273 . . . . 0.0 109.536 178.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 68.8 ttt180 57.65 55.68 5.4 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.767 1.627 . . . . 0.0 111.653 178.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -72.56 140.53 48.15 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.001 0.92 . . . . 0.0 112.616 -172.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 60.6 mtp85 -129.32 168.53 16.11 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.766 1.626 . . . . 0.0 110.26 -174.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 51.5 mtm180 -61.84 -17.58 56.88 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 115.598 1.703 . . . . 0.0 115.598 -169.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -71.37 -22.84 61.84 Favored 'General case' 0 CA--C 1.553 1.064 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 169.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 -86.55 -13.54 45.56 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 125.377 1.471 . . . . 0.0 113.574 -176.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 41.4 m -55.61 137.82 48.29 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 120.986 -1.071 . . . . 0.0 111.183 169.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 151.61 -165.98 30.65 Favored Glycine 0 N--CA 1.471 0.97 0 O-C-N 121.445 -0.785 . . . . 0.0 113.504 -176.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.9 m -98.5 140.83 32.16 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.879 1.272 . . . . 0.0 110.895 -172.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -140.26 154.12 46.75 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.084 1.354 . . . . 0.0 112.568 -175.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.3 pp -158.35 153.99 26.32 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.944 1.298 . . . . 0.0 112.778 179.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 14.4 m -95.47 159.91 14.77 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.604 0.761 . . . . 0.0 112.121 172.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -143.8 175.26 23.82 Favored Glycine 0 CA--C 1.527 0.823 0 C-N-CA 125.35 1.452 . . . . 0.0 111.56 168.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -158.54 159.24 35.33 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 118.635 1.217 . . . . 0.0 113.96 -178.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 16.9 tt -150.22 138.94 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 125.417 1.487 . . . . 0.0 110.564 177.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 13.5 m -69.51 159.67 32.88 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.321 1.048 . . . . 0.0 112.668 176.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 40.9 mt -75.17 -11.87 60.17 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 177.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -65.59 148.78 97.93 Favored Pre-proline 0 CA--C 1.552 1.029 0 C-N-CA 124.405 1.082 . . . . 0.0 112.367 175.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -69.47 -20.19 36.55 Favored 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 123.141 2.561 . . . . 0.0 113.194 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -87.23 3.64 45.75 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.715 1.206 . . . . 0.0 113.886 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -67.31 164.56 18.18 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.871 1.268 . . . . 0.0 113.957 -175.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 22.1 pt20 -149.1 163.5 37.4 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.417 1.887 . . . . 0.0 109.756 176.28 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 54.8 mt -83.83 135.78 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 CA-C-O 121.554 0.693 . . . . 0.0 112.744 -171.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -95.99 144.67 26.08 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 127.502 2.321 . . . . 0.0 109.74 167.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.9 mp0 -143.03 158.82 43.24 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 126.543 1.937 . . . . 0.0 109.801 170.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 4.1 t -150.08 -170.35 3.62 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 175.07 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -61.5 130.68 47.17 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.13 1.772 . . . . 0.0 114.109 -169.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.73 167.18 22.31 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 115.872 1.804 . . . . 0.0 115.872 -169.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -123.27 169.67 11.06 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 127.33 2.252 . . . . 0.0 110.812 169.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -126.64 143.97 51.06 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.994 1.318 . . . . 0.0 111.846 -177.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 49.8 tp -114.08 136.7 52.64 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 126.354 1.861 . . . . 0.0 110.293 173.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 59.6 ttt85 -127.49 123.37 35.78 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 126.171 1.788 . . . . 0.0 109.944 170.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 44.9 t -102.96 123.57 56.45 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 124.612 1.165 . . . . 0.0 108.679 169.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 79.6 p -99.77 158.64 15.64 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.744 1.618 . . . . 0.0 110.882 176.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -58.52 150.85 21.69 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.421 1.088 . . . . 0.0 112.894 -178.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 11.9 ttm180 . . . . . 0 C--O 1.237 0.416 0 C-N-CA 123.695 0.798 . . . . 0.0 109.982 -174.619 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 33.7 m . . . . . 0 N--CA 1.471 0.621 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -143.28 117.91 9.81 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.671 1.589 . . . . 0.0 109.043 179.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 88.6 p -140.94 159.89 60.36 Favored Pre-proline 0 CA--C 1.551 0.994 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 -168.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.3 162.51 79.31 Favored 'Cis proline' 0 C--N 1.356 0.925 0 CA-C-N 120.058 1.057 . . . . 0.0 111.912 -3.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.74 -24.05 67.61 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 177.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 47.9 tp -142.0 124.15 15.49 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 125.341 1.457 . . . . 0.0 108.658 169.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 53.7 tp -111.25 126.57 55.02 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.064 1.346 . . . . 0.0 109.255 171.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.2 t -111.51 122.57 66.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.966 0.907 . . . . 0.0 109.252 175.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.1 m -126.63 173.24 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 125.132 1.373 . . . . 0.0 111.342 170.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 99.1 m -104.84 151.79 23.4 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.49 1.516 . . . . 0.0 110.228 172.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -51.77 125.56 15.38 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.281 1.032 . . . . 0.0 112.562 174.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.84 -3.46 74.07 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 126.054 1.788 . . . . 0.0 114.531 -176.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -92.61 154.37 18.43 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 119.594 1.697 . . . . 0.0 111.523 175.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -85.17 127.39 34.25 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 121.505 0.669 . . . . 0.0 111.305 171.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -103.83 128.13 51.29 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.737 1.615 . . . . 0.0 110.083 178.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 27.7 m -128.66 127.87 43.02 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.064 0.945 . . . . 0.0 111.371 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -103.28 158.83 16.05 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.553 1.941 . . . . 0.0 110.59 170.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 85.5 m -101.2 134.21 44.59 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.058 1.343 . . . . 0.0 109.261 169.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 44.8 t -115.16 134.06 55.49 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.432 1.893 . . . . 0.0 110.011 170.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 66.8 m -138.69 130.34 27.63 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.194 0.997 . . . . 0.0 111.042 -173.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 40.9 p90 . . . . . 0 CA--C 1.537 0.469 0 C-N-CA 125.494 1.518 . . . . 0.0 110.535 179.428 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 40.8 p90 . . . . . 0 CA--C 1.538 0.5 0 CA-C-O 120.993 0.425 . . . . 0.0 111.924 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 87.7 t -111.03 128.43 67.48 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 C-N-CA 125.612 1.565 . . . . 0.0 108.075 169.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 58.8 tp -106.37 134.05 50.11 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 125.243 1.417 . . . . 0.0 108.883 169.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -127.16 150.47 49.49 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.152 1.381 . . . . 0.0 110.825 178.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 11.7 t90 -117.62 139.99 50.24 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.473 1.109 . . . . 0.0 111.236 176.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -133.29 146.86 51.77 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.703 1.201 . . . . 0.0 113.626 -172.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -111.07 138.67 47.19 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.608 1.563 . . . . 0.0 108.276 168.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 28.3 mtp -85.05 143.62 28.77 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 118.846 0.748 . . . . 0.0 112.339 -178.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.4 m -100.43 154.05 37.41 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 125.212 1.405 . . . . 0.0 111.918 178.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.83 -30.98 79.17 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 124.442 3.428 . . . . 0.0 114.704 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.0 m -77.0 10.74 2.13 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.079 1.352 . . . . 0.0 113.593 178.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 66.38 43.6 2.63 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.775 2.03 . . . . 0.0 111.353 -176.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 -121.55 -172.73 2.48 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.551 1.541 . . . . 0.0 109.88 175.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.1 p -144.74 144.23 31.09 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.638 1.575 . . . . 0.0 110.609 -173.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -121.54 132.43 54.7 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.721 1.208 . . . . 0.0 111.347 176.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -77.66 128.27 33.82 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.866 1.266 . . . . 0.0 111.335 -177.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 60.0 mt -104.7 -44.5 4.85 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.196 1.398 . . . . 0.0 113.544 -168.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -171.27 174.93 4.38 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 128.085 2.554 . . . . 0.0 109.395 -174.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.6 166.57 30.45 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.314 1.046 . . . . 0.0 112.769 -170.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -142.89 115.25 6.03 Favored Pre-proline 0 CA--C 1.546 0.821 0 C-N-CA 125.435 1.494 . . . . 0.0 109.67 169.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo . . . . . 0 C--N 1.351 0.705 0 CA-C-N 119.941 1.015 . . . . 0.0 112.665 -10.75 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 13.0 ptp180 . . . . . 0 N--CA 1.473 0.695 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -93.99 140.02 30.22 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.32 1.448 . . . . 0.0 111.339 -176.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -137.86 145.27 41.99 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.298 1.439 . . . . 0.0 111.123 178.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 58.1 t -126.54 125.23 66.87 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 125.538 1.535 . . . . 0.0 108.734 174.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 84.8 m -130.49 129.28 42.72 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.818 1.247 . . . . 0.0 110.655 -174.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.7 pm0 -76.61 141.32 41.1 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.792 1.237 . . . . 0.0 111.605 175.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 38.0 mt -93.92 157.82 37.34 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 123.829 0.852 . . . . 0.0 111.628 177.061 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -65.71 -3.56 8.24 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 123.551 2.834 . . . . 0.0 114.028 174.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -62.41 -26.14 68.33 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 119.441 1.018 . . . . 0.0 112.739 169.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 92.34 -15.7 61.6 Favored Glycine 0 N--CA 1.474 1.226 0 C-N-CA 125.659 1.599 . . . . 0.0 114.547 175.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.41 73.51 0.91 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.769 1.628 . . . . 0.0 109.995 170.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -174.64 147.43 1.06 Allowed 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 127.223 2.209 . . . . 0.0 109.054 -177.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 60.6 m-85 -143.62 151.29 39.96 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 114.103 1.149 . . . . 0.0 114.103 -168.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 13.5 m170 -110.01 139.32 45.25 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.684 1.594 . . . . 0.0 109.625 167.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 46.1 mtt -128.84 123.73 33.53 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.896 1.278 . . . . 0.0 109.212 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 88.9 p -130.48 139.12 50.54 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 115.739 1.755 . . . . 0.0 115.739 -168.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 15.5 t -98.11 104.02 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 125.922 1.689 . . . . 0.0 106.656 169.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 60.7 t -81.48 128.67 38.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 123.647 0.779 . . . . 0.0 109.868 -176.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 50.1 ttt85 56.23 53.62 8.7 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.224 1.41 . . . . 0.0 111.017 178.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.43 145.83 55.64 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.614 1.166 . . . . 0.0 112.106 -170.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 33.8 mmm-85 -118.92 168.05 11.15 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.884 1.674 . . . . 0.0 110.489 178.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 44.3 mtm180 -57.78 -20.54 36.08 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 120.862 -1.149 . . . . 0.0 113.738 173.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -59.57 -22.86 62.34 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.248 1.419 . . . . 0.0 113.893 168.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -94.92 -13.28 25.54 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.214 1.406 . . . . 0.0 114.435 -175.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 67.2 m -60.71 134.89 57.53 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-N 120.349 1.431 . . . . 0.0 112.616 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 155.92 -165.78 32.76 Favored Glycine 0 N--CA 1.473 1.139 0 O-C-N 121.247 -0.908 . . . . 0.0 113.571 -177.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.0 m -95.98 139.61 31.93 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.501 1.12 . . . . 0.0 110.747 -177.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 61.3 m-85 -137.41 156.39 48.25 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.074 1.75 . . . . 0.0 112.558 -176.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -161.96 147.85 13.39 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.797 1.639 . . . . 0.0 112.134 176.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 24.7 p -94.46 159.16 15.23 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.698 0.799 . . . . 0.0 112.655 169.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -148.07 131.48 3.84 Favored Glycine 0 CA--C 1.529 0.91 0 C-N-CA 124.766 1.174 . . . . 0.0 112.639 173.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -115.11 147.41 40.26 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.563 1.145 . . . . 0.0 112.634 -176.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 18.6 tt -148.14 136.38 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 125.189 1.396 . . . . 0.0 111.007 178.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 31.5 m -72.15 155.38 40.32 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 121.101 -0.999 . . . . 0.0 111.853 174.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.68 -10.78 58.34 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 115.775 1.769 . . . . 0.0 115.775 -174.708 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -75.27 140.63 73.0 Favored Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 124.137 0.975 . . . . 0.0 111.935 179.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -55.28 -23.43 37.39 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 123.875 3.05 . . . . 0.0 114.797 174.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -71.2 -13.91 62.08 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 124.968 1.307 . . . . 0.0 114.099 177.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -74.73 161.47 29.6 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.24 1.416 . . . . 0.0 113.839 -176.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 28.5 mp0 -132.41 156.99 45.68 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.379 1.872 . . . . 0.0 108.573 170.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 33.7 mt -75.91 116.38 18.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 O-C-N 121.731 -0.606 . . . . 0.0 109.98 178.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.3 88.47 4.94 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.026 0.93 . . . . 0.0 109.358 169.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -77.38 131.32 37.99 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.466 1.106 . . . . 0.0 110.911 179.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 76.8 p -81.42 166.91 19.97 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 115.333 1.605 . . . . 0.0 115.333 -174.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 10.1 mp -67.29 114.5 6.05 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.103 0.961 . . . . 0.0 109.271 171.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.06 150.89 44.44 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -173.025 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -131.83 169.65 15.95 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 126.422 1.889 . . . . 0.0 112.442 178.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -110.89 139.66 46.03 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.078 1.351 . . . . 0.0 112.333 -177.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 59.6 tp -109.0 128.02 54.58 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 126.063 1.745 . . . . 0.0 108.938 168.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -118.77 117.01 27.74 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.494 1.518 . . . . 0.0 109.53 173.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 34.9 t -102.58 117.83 48.55 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 C-N-CA 124.347 1.059 . . . . 0.0 108.563 169.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 81.6 p -95.96 156.95 16.12 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.895 1.678 . . . . 0.0 111.304 -178.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -59.05 142.32 51.65 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.45 1.1 . . . . 0.0 113.224 -171.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? . . . . . 0 N--CA 1.467 0.385 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 172.805 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 6.4 t . . . . . 0 N--CA 1.471 0.598 0 CA-C-O 121.228 0.537 . . . . 0.0 112.206 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -148.07 116.74 6.66 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.997 2.119 . . . . 0.0 109.232 -175.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 73.0 m -140.82 160.65 57.77 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 124.621 1.168 . . . . 0.0 113.17 -169.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -71.53 156.34 97.09 Favored 'Cis proline' 0 C--N 1.352 0.75 0 CA-C-N 119.535 0.87 . . . . 0.0 111.305 -5.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.44 -20.09 64.16 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 176.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 36.2 tp -141.9 120.16 12.25 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.642 1.577 . . . . 0.0 108.874 169.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 62.1 tp -109.92 122.36 47.36 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.156 1.382 . . . . 0.0 108.98 169.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.2 t -106.25 123.8 61.2 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 172.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.5 m -128.05 176.23 8.1 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 124.828 1.251 . . . . 0.0 111.092 171.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 52.7 m -110.12 151.5 27.16 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.605 1.562 . . . . 0.0 110.519 175.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -54.33 125.16 18.26 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.906 1.282 . . . . 0.0 112.201 178.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 97.3 -9.16 64.97 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 127.224 2.345 . . . . 0.0 114.301 -174.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -81.38 160.53 24.07 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 119.927 1.863 . . . . 0.0 112.547 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -91.88 111.34 22.84 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.473 1.109 . . . . 0.0 109.302 172.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -96.52 118.64 33.45 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.098 0.959 . . . . 0.0 111.143 -175.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 28.5 m -123.08 125.26 44.86 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.566 0.746 . . . . 0.0 112.13 -173.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -101.76 159.55 15.23 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.909 1.683 . . . . 0.0 110.755 169.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 21.0 m -110.67 128.91 55.89 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.179 1.392 . . . . 0.0 110.037 174.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 42.5 t -115.06 150.89 35.2 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.916 1.687 . . . . 0.0 111.67 171.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 62.0 p -148.28 143.86 27.23 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.254 -0.904 . . . . 0.0 111.362 169.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 . . . . . 0 N--CA 1.471 0.583 0 C-N-CA 126.251 1.82 . . . . 0.0 114.677 -176.665 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 55.0 p90 . . . . . 0 CA--C 1.539 0.527 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 75.9 t -96.12 133.72 36.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 C-N-CA 125.636 1.574 . . . . 0.0 107.302 168.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.5 tp -99.3 147.6 25.02 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.714 1.206 . . . . 0.0 110.123 174.143 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 23.0 m120 -136.21 154.3 50.97 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.745 1.618 . . . . 0.0 111.382 -176.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 12.6 t90 -129.84 137.9 50.7 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.425 1.09 . . . . 0.0 111.787 177.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -134.02 145.73 49.72 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 -174.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 56.7 ttt85 -101.92 142.03 33.85 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.26 1.424 . . . . 0.0 107.883 166.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 29.6 mtp -88.25 144.34 26.5 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 118.657 0.662 . . . . 0.0 112.54 175.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 74.3 m -106.45 149.47 38.35 Favored Pre-proline 0 CA--C 1.545 0.755 0 C-N-CA 125.43 1.492 . . . . 0.0 111.161 173.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -68.37 -15.86 42.73 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 124.016 3.144 . . . . 0.0 114.013 -173.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 18.4 m -76.94 8.96 3.24 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.813 1.245 . . . . 0.0 113.027 172.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 58.1 t30 70.53 45.75 0.59 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 127.693 2.397 . . . . 0.0 111.507 -177.555 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -128.93 -179.53 5.15 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.56 1.544 . . . . 0.0 110.368 -179.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.7 p -142.2 152.52 43.21 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 126.02 1.728 . . . . 0.0 110.503 -175.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -131.05 131.89 44.57 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.515 1.126 . . . . 0.0 111.177 174.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -77.69 121.23 23.72 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.473 1.109 . . . . 0.0 110.89 -178.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 48.0 mt -94.27 -45.01 7.69 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.476 1.51 . . . . 0.0 111.82 -173.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -168.35 175.64 6.29 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.497 1.919 . . . . 0.0 110.565 -171.059 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -158.41 165.8 33.78 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.435 1.494 . . . . 0.0 111.57 -175.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -153.06 117.11 2.82 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 124.233 1.013 . . . . 0.0 111.39 172.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo . . . . . 0 C--N 1.35 0.63 0 CA-C-N 119.665 0.916 . . . . 0.0 111.981 -12.463 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 35.2 mtp-105 . . . . . 0 N--CA 1.47 0.556 0 N-CA-C 113.187 0.81 . . . . 0.0 113.187 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 99.6 m-85 -97.52 116.25 29.37 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.856 1.263 . . . . 0.0 109.908 -178.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -130.37 141.25 50.57 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.714 1.205 . . . . 0.0 111.332 -172.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 47.5 t -126.53 125.93 68.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 C-N-CA 125.085 1.354 . . . . 0.0 109.706 178.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 87.3 m -130.54 131.29 44.98 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.925 1.29 . . . . 0.0 110.674 -176.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -79.66 140.76 36.94 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.923 0.889 . . . . 0.0 111.91 176.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 27.1 mt -95.1 157.1 37.05 Favored Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 125.586 1.554 . . . . 0.0 111.67 178.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -70.76 -2.76 11.41 Favored 'Trans proline' 0 CA--C 1.542 0.915 0 C-N-CA 123.619 2.88 . . . . 0.0 114.177 175.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -70.24 -8.95 54.17 Favored 'General case' 0 CA--C 1.555 1.141 0 N-CA-C 114.109 1.152 . . . . 0.0 114.109 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 108.03 -33.95 5.94 Favored Glycine 0 N--CA 1.476 1.336 0 C-N-CA 125.903 1.716 . . . . 0.0 116.443 168.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.49 73.28 0.9 Allowed 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.453 1.627 . . . . 0.0 110.224 169.599 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -157.45 142.37 16.79 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 125.171 1.389 . . . . 0.0 109.34 -167.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -149.45 135.17 18.65 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.056 0.542 . . . . 0.0 111.724 -169.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -90.99 136.25 33.2 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.022 0.929 . . . . 0.0 111.129 169.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 32.9 mtt -121.22 106.03 11.12 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 126.063 1.745 . . . . 0.0 109.38 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 33.8 t -110.98 128.88 55.98 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.257 1.023 . . . . 0.0 113.416 -169.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 28.2 t -96.88 100.85 11.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 C-N-CA 125.865 1.666 . . . . 0.0 106.61 168.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 89.0 t -73.96 129.23 36.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 124.09 0.956 . . . . 0.0 109.924 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 60.57 57.02 2.88 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.137 1.375 . . . . 0.0 110.967 173.577 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.78 156.31 39.46 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.338 1.055 . . . . 0.0 113.211 -171.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 23.6 mtm180 -133.66 160.68 36.81 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 126.533 1.933 . . . . 0.0 109.716 -168.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 32.2 mtp85 -55.65 -27.49 50.15 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 120.03 1.286 . . . . 0.0 113.258 171.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -69.89 -20.67 63.37 Favored 'General case' 0 CA--C 1.553 1.084 0 N-CA-C 114.476 1.287 . . . . 0.0 114.476 172.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -83.24 -9.81 58.92 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 121.061 -1.024 . . . . 0.0 112.879 175.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 71.2 m -59.88 135.6 57.75 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 120.211 -1.555 . . . . 0.0 111.634 173.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 160.27 -172.75 36.77 Favored Glycine 0 CA--C 1.53 1.028 0 C-N-CA 124.529 1.062 . . . . 0.0 113.365 -179.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.0 m -91.13 140.92 29.36 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.802 0.841 . . . . 0.0 109.985 176.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 52.9 m-85 -133.82 160.17 38.44 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.232 1.813 . . . . 0.0 110.632 178.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -155.99 149.54 24.85 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 124.299 1.04 . . . . 0.0 112.684 175.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 36.7 t -89.57 158.64 17.56 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.149 1.38 . . . . 0.0 111.054 173.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -149.32 170.43 29.59 Favored Glycine 0 N--CA 1.471 1.026 0 C-N-CA 125.634 1.587 . . . . 0.0 112.282 174.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -156.68 159.21 38.17 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 173.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 21.0 tt -140.8 135.6 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 125.846 1.658 . . . . 0.0 109.934 174.253 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 19.9 m -69.31 160.79 30.59 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.515 0.726 . . . . 0.0 112.821 -179.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.53 -15.88 63.73 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 115.421 1.637 . . . . 0.0 115.421 -173.518 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -78.68 149.09 74.06 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 124.776 1.23 . . . . 0.0 112.445 -177.253 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -67.68 -22.48 43.73 Favored 'Trans proline' 0 CA--C 1.54 0.775 0 C-N-CA 123.125 2.55 . . . . 0.0 113.09 -179.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -79.19 -2.95 43.34 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 114.687 1.365 . . . . 0.0 114.687 176.199 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.46 167.71 16.07 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.769 1.228 . . . . 0.0 113.319 -178.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 22.3 pt20 -146.8 161.3 40.96 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.207 1.803 . . . . 0.0 109.312 173.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 20.9 mt -77.65 118.9 25.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 O-C-N 121.609 -0.682 . . . . 0.0 111.126 -174.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -89.76 128.14 36.07 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.313 1.445 . . . . 0.0 109.426 168.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -87.12 145.39 26.46 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.347 1.059 . . . . 0.0 110.861 178.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 5.8 t -94.36 -166.8 1.55 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.44 1.096 . . . . 0.0 112.237 172.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -68.02 153.01 44.64 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.33 1.452 . . . . 0.0 111.676 174.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 25.7 mtp-105 -91.15 146.51 23.77 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 125.346 1.458 . . . . 0.0 110.906 172.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -143.0 150.03 39.09 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.269 1.427 . . . . 0.0 111.837 178.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -93.0 132.49 37.04 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.599 1.16 . . . . 0.0 111.818 177.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 48.1 tp -103.63 126.33 50.71 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 166.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 33.6 ttm180 -128.38 109.94 11.89 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 124.342 1.057 . . . . 0.0 109.01 -178.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 21.8 t -102.32 119.53 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 123.872 0.869 . . . . 0.0 108.727 178.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 70.1 p -93.36 147.72 22.68 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 126.064 1.746 . . . . 0.0 109.887 178.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 10.6 pm0 -57.43 150.23 19.02 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.741 0.817 . . . . 0.0 112.592 -179.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 47.2 ttt85 . . . . . 0 C--O 1.236 0.358 0 C-N-CA 124.079 0.952 . . . . 0.0 110.918 -168.312 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.2 t . . . . . 0 N--CA 1.471 0.603 0 CA-C-O 121.25 0.548 . . . . 0.0 112.126 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -144.97 115.31 7.56 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 126.415 1.886 . . . . 0.0 108.493 175.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 93.3 p -140.88 159.31 62.72 Favored Pre-proline 0 CA--C 1.55 0.954 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 -168.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -69.84 161.6 86.1 Favored 'Cis proline' 0 C--N 1.354 0.867 0 CA-C-N 119.488 0.853 . . . . 0.0 111.6 -6.088 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.68 -24.49 67.8 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.148 0.795 . . . . 0.0 113.148 176.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 46.4 tp -141.0 121.26 13.89 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.639 1.576 . . . . 0.0 108.784 169.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 57.0 tp -107.17 125.45 51.11 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.241 1.417 . . . . 0.0 109.078 171.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.4 t -109.61 123.54 65.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.089 0.956 . . . . 0.0 108.702 173.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 26.8 m -127.42 164.38 28.53 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 124.707 1.203 . . . . 0.0 111.451 172.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 51.9 m -90.66 149.43 22.09 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.272 1.029 . . . . 0.0 110.451 171.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -56.98 123.66 15.93 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.117 0.967 . . . . 0.0 111.834 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 87.92 3.53 79.83 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 126.106 1.812 . . . . 0.0 114.569 -175.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -92.27 157.6 16.57 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.487 1.644 . . . . 0.0 111.569 170.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -82.45 130.37 35.09 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.187 0.995 . . . . 0.0 110.635 177.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -112.9 124.72 53.25 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.787 1.235 . . . . 0.0 111.099 -178.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 28.4 m -129.76 125.4 35.75 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 119.184 0.902 . . . . 0.0 112.078 -176.437 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -100.41 151.26 21.74 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.697 1.599 . . . . 0.0 110.621 169.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 58.0 m -99.54 130.39 45.78 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.292 1.437 . . . . 0.0 109.112 173.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 44.5 t -125.06 143.51 50.88 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 126.242 1.817 . . . . 0.0 111.496 177.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 96.3 p -153.97 156.82 38.16 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.103 -0.998 . . . . 0.0 113.131 168.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 . . . . . 0 CA--C 1.536 0.406 0 C-N-CA 126.846 2.058 . . . . 0.0 111.25 178.607 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 34.7 p90 . . . . . 0 CA--C 1.543 0.711 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 21.4 t -107.83 134.1 50.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 125.848 1.659 . . . . 0.0 109.027 169.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -104.53 141.08 37.02 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.648 1.179 . . . . 0.0 109.282 168.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -137.7 158.04 45.2 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.471 1.508 . . . . 0.0 111.182 -170.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 10.0 t90 -129.09 138.02 51.59 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.417 1.087 . . . . 0.0 112.187 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -131.19 141.41 50.05 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.247 1.419 . . . . 0.0 112.977 -175.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 48.7 ttp180 -101.11 143.98 30.56 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.936 2.094 . . . . 0.0 108.718 169.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 36.8 mtp -93.65 141.86 28.0 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.854 0.752 . . . . 0.0 112.398 178.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.0 m -92.21 158.49 39.06 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 124.849 1.26 . . . . 0.0 111.709 175.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_exo -55.81 -33.44 88.2 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 123.949 3.099 . . . . 0.0 114.192 177.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 12.6 m -77.03 8.28 4.03 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.201 1.4 . . . . 0.0 113.821 177.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 60.3 t30 70.19 22.84 5.38 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 127.279 2.232 . . . . 0.0 113.259 -178.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 45.4 mt-30 -90.14 -176.73 4.95 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.423 1.089 . . . . 0.0 110.364 169.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.6 p -138.3 152.18 48.28 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.515 1.526 . . . . 0.0 111.165 -175.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -132.58 129.33 38.86 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 126.505 1.922 . . . . 0.0 110.155 -176.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 44.9 tttm -85.76 121.5 28.51 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.194 0.998 . . . . 0.0 111.252 -171.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 53.5 mt -97.6 -48.69 5.15 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.914 1.285 . . . . 0.0 113.124 -168.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -170.66 172.68 5.71 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.88 1.672 . . . . 0.0 110.972 -172.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.59 165.49 32.7 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.993 1.317 . . . . 0.0 112.629 -177.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -140.63 121.0 8.86 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 125.684 1.594 . . . . 0.0 109.822 170.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo . . . . . 0 C--N 1.351 0.694 0 CA-C-N 120.065 1.059 . . . . 0.0 112.96 -9.404 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 44.0 mtp-105 . . . . . 0 N--CA 1.476 0.838 0 N-CA-C 111.995 0.368 . . . . 0.0 111.995 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -92.46 130.4 38.14 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.978 1.311 . . . . 0.0 108.56 173.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -131.06 152.15 50.67 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.083 1.353 . . . . 0.0 111.374 -177.249 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 97.4 t -126.61 123.21 62.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 125.534 1.533 . . . . 0.0 108.88 175.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 95.8 m -122.77 126.95 48.47 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.326 1.05 . . . . 0.0 110.787 -177.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 3.2 tp-100 -76.18 134.72 39.83 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.645 1.578 . . . . 0.0 109.989 171.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 33.3 mt -90.29 164.39 27.62 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 124.054 0.942 . . . . 0.0 112.004 176.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -55.37 -21.28 28.93 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 123.872 3.048 . . . . 0.0 114.172 172.058 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -60.19 -26.16 66.14 Favored 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 176.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 89.84 -17.25 53.99 Favored Glycine 0 CA--C 1.535 1.32 0 C-N-CA 125.355 1.455 . . . . 0.0 114.602 173.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 5.3 ptt180 -152.44 73.54 1.03 Allowed 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 123.024 1.393 . . . . 0.0 109.178 169.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -169.92 137.54 1.65 Allowed 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 128.322 2.649 . . . . 0.0 107.304 -179.081 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -141.58 145.44 35.07 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 114.46 1.282 . . . . 0.0 114.46 -166.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 -102.53 121.22 41.94 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.044 1.338 . . . . 0.0 110.506 168.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -101.29 103.85 14.84 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 126.467 1.907 . . . . 0.0 107.948 176.369 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 14.8 m -114.52 121.88 44.84 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 114.136 1.162 . . . . 0.0 114.136 -167.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 12.8 t -88.59 118.04 33.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 C-N-CA 125.084 1.354 . . . . 0.0 107.509 168.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 98.0 t -78.86 117.31 24.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 124.25 1.02 . . . . 0.0 109.21 173.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 55.6 mtp180 48.37 76.92 0.11 Allowed 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 126.787 2.035 . . . . 0.0 111.876 178.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -69.77 138.17 52.53 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.422 1.089 . . . . 0.0 111.891 -176.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.78 161.16 17.88 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 126.235 1.814 . . . . 0.0 110.195 178.342 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 76.9 mtm180 -56.76 -23.07 40.28 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 114.387 1.255 . . . . 0.0 114.387 -178.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -65.16 -23.6 67.15 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 170.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -82.13 -16.84 48.52 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.226 1.01 . . . . 0.0 113.365 -178.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 49.8 m -59.59 134.67 57.23 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 119.743 1.156 . . . . 0.0 112.693 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 152.68 -169.12 31.75 Favored Glycine 0 N--CA 1.472 1.086 0 C-N-CA 124.812 1.196 . . . . 0.0 113.249 -174.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.0 m -93.12 147.49 22.82 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.314 1.046 . . . . 0.0 111.146 -178.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -141.52 159.49 42.1 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.804 2.041 . . . . 0.0 111.5 -177.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.0 pp -154.34 154.1 32.77 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.618 1.567 . . . . 0.0 111.152 172.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 29.5 p -102.13 157.7 16.7 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.305 0.642 . . . . 0.0 112.566 171.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -149.06 145.16 13.17 Favored Glycine 0 N--CA 1.472 1.075 0 C-N-CA 124.997 1.284 . . . . 0.0 113.89 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -125.38 159.26 32.25 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.971 1.309 . . . . 0.0 113.04 -173.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 16.9 tt -159.5 137.57 2.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 125.332 1.453 . . . . 0.0 111.176 178.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 17.8 m -70.92 161.45 31.03 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.143 0.977 . . . . 0.0 112.664 175.059 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 17.8 mt -77.04 -12.56 59.95 Favored 'General case' 0 N--CA 1.479 0.994 0 O-C-N 120.69 -1.256 . . . . 0.0 114.335 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -65.82 143.83 98.65 Favored Pre-proline 0 CA--C 1.552 1.041 0 C-N-CA 124.046 0.939 . . . . 0.0 112.377 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_exo -55.58 -27.67 61.21 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 123.782 2.988 . . . . 0.0 114.695 176.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -83.24 -1.61 53.56 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.719 1.208 . . . . 0.0 114.218 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -67.94 162.77 23.59 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.366 1.066 . . . . 0.0 113.474 -177.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.27 153.21 38.4 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.812 1.645 . . . . 0.0 108.814 178.004 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 64.9 mt -76.53 124.75 35.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 123.631 0.773 . . . . 0.0 111.828 -173.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -97.11 145.46 25.98 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.695 1.198 . . . . 0.0 108.116 165.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -130.16 148.96 52.05 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.461 1.028 . . . . 0.0 111.818 -179.059 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 4.9 t -94.51 -166.11 1.42 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.011 1.325 . . . . 0.0 113.126 -173.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 82.8 mt -64.68 155.3 33.93 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.615 1.566 . . . . 0.0 111.734 175.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 31.0 mtp-105 -89.38 139.22 30.73 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.548 1.139 . . . . 0.0 110.444 173.043 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -137.11 151.01 48.37 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.413 1.485 . . . . 0.0 111.419 178.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -103.85 137.76 41.4 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.428 1.091 . . . . 0.0 111.754 -177.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 63.1 tp -106.14 128.97 54.27 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 125.747 1.619 . . . . 0.0 108.905 169.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 71.4 ttt180 -120.52 118.24 29.71 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.516 1.527 . . . . 0.0 109.399 171.268 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 32.8 t -102.17 119.44 50.48 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 C-N-CA 124.494 1.118 . . . . 0.0 108.432 170.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 63.0 p -99.66 144.77 28.36 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.526 1.531 . . . . 0.0 110.078 179.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -62.82 145.07 55.86 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.795 -0.566 . . . . 0.0 112.459 -174.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 46.9 ttt85 . . . . . 0 N--CA 1.468 0.427 0 C-N-CA 124.196 0.999 . . . . 0.0 110.857 -171.476 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.0 t . . . . . 0 N--CA 1.471 0.59 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.407 ' CD1' ' SG ' ' A' ' 123' ' ' CYS . 1.4 m-85 -127.39 141.95 51.55 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.143 0.977 . . . . 0.0 112.048 -168.202 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 95.9 p -141.08 159.39 61.89 Favored Pre-proline 0 CA--C 1.548 0.9 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 177.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -73.15 161.54 93.69 Favored 'Cis proline' 0 C--N 1.353 0.802 0 CA-C-N 118.925 0.652 . . . . 0.0 111.096 -11.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.5 -29.44 70.55 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 171.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 49.1 tp -140.53 121.93 15.01 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.82 1.648 . . . . 0.0 109.453 171.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 56.5 tp -104.81 126.68 52.13 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.74 1.616 . . . . 0.0 109.068 171.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 18.3 t -110.18 125.45 67.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 123.999 0.92 . . . . 0.0 108.533 171.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.1 m -129.47 165.14 30.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 124.671 1.188 . . . . 0.0 111.653 174.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 88.5 m -92.12 148.6 22.05 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.295 1.038 . . . . 0.0 109.849 171.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -56.23 123.8 15.78 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.987 0.915 . . . . 0.0 112.076 -177.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 93.58 -2.98 71.03 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 125.421 1.486 . . . . 0.0 114.74 -175.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -71.16 153.24 42.65 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.624 1.712 . . . . 0.0 111.461 169.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -84.28 106.53 15.97 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 169.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -94.25 123.18 37.49 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.863 0.865 . . . . 0.0 110.928 -172.047 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 42.0 m -131.63 126.83 35.69 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 119.051 0.841 . . . . 0.0 112.313 -170.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -98.29 156.74 16.57 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 126.139 1.776 . . . . 0.0 110.506 170.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.8 m -105.64 129.74 53.82 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.834 1.254 . . . . 0.0 109.18 171.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 67.8 m -115.84 124.4 50.59 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.58 1.152 . . . . 0.0 109.104 169.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 73.1 m -121.55 126.37 49.0 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 124.748 1.219 . . . . 0.0 110.075 -170.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 10.9 p90 . . . . . 0 CA--C 1.539 0.548 0 C-N-CA 124.961 1.304 . . . . 0.0 110.583 177.237 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 53.1 p90 . . . . . 0 CA--C 1.541 0.607 0 CA-C-O 121.284 0.564 . . . . 0.0 112.283 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 17.6 t -125.42 133.68 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 125.744 1.617 . . . . 0.0 107.786 168.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -105.89 136.17 46.02 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.138 1.375 . . . . 0.0 108.913 173.552 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -126.82 150.96 48.92 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.119 1.367 . . . . 0.0 111.502 178.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 14.0 t90 -127.59 138.93 53.01 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.242 1.417 . . . . 0.0 111.847 178.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -134.74 151.31 50.88 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.612 1.565 . . . . 0.0 113.815 -171.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -112.08 141.19 46.07 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.556 1.542 . . . . 0.0 109.328 168.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 84.5 mmm -73.79 137.73 44.06 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.473 0.709 . . . . 0.0 111.642 174.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 67.7 m -94.26 156.6 38.68 Favored Pre-proline 0 CA--C 1.548 0.882 0 C-N-CA 124.723 1.209 . . . . 0.0 111.57 170.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -55.65 -32.74 84.76 Favored 'Trans proline' 0 C--N 1.354 0.857 0 C-N-CA 124.038 3.159 . . . . 0.0 114.648 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.3 m -76.99 5.73 7.52 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.804 1.241 . . . . 0.0 113.835 178.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 72.93 21.01 3.38 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 127.843 2.457 . . . . 0.0 112.98 -175.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -90.41 -175.08 4.36 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.589 1.156 . . . . 0.0 110.314 170.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.9 p -139.02 145.26 39.42 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 125.618 1.567 . . . . 0.0 110.024 -175.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -121.27 131.48 54.24 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.165 0.986 . . . . 0.0 111.193 176.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -80.97 123.07 28.03 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.237 1.415 . . . . 0.0 110.773 -175.012 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 45.5 mt -100.94 -53.54 3.02 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.864 1.266 . . . . 0.0 112.2 -168.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -161.16 167.28 26.46 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.273 1.829 . . . . 0.0 110.014 -169.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.63 166.85 29.8 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.974 0.91 . . . . 0.0 112.292 -172.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 74.1 t80 -144.99 114.57 4.99 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 124.511 1.124 . . . . 0.0 110.558 170.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo . . . . . 0 C--N 1.351 0.671 0 CA-C-N 119.772 0.954 . . . . 0.0 112.567 -11.339 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 . . . . . 0 N--CA 1.475 0.784 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -95.8 140.94 29.86 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.427 1.091 . . . . 0.0 112.161 -168.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 58.9 ttt180 -144.54 147.27 33.01 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.11 1.364 . . . . 0.0 112.081 176.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 84.7 t -115.72 126.74 73.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 126.176 1.791 . . . . 0.0 108.763 170.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 98.5 m -130.51 132.29 45.55 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.361 1.464 . . . . 0.0 110.39 -177.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -77.68 138.47 39.09 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.09 0.556 . . . . 0.0 110.231 172.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 20.2 mt -76.85 156.44 82.55 Favored Pre-proline 0 CA--C 1.544 0.743 0 O-C-N 121.704 -0.622 . . . . 0.0 111.788 171.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -66.46 -6.4 15.03 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.504 2.802 . . . . 0.0 113.44 172.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -60.04 -26.09 65.85 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 124.086 0.955 . . . . 0.0 112.98 169.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 88.28 -10.58 70.69 Favored Glycine 0 CA--C 1.534 1.246 0 C-N-CA 125.079 1.323 . . . . 0.0 115.041 178.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 32.6 ptt180 -154.58 73.61 0.91 Allowed 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 118.76 1.28 . . . . 0.0 111.533 173.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -178.76 148.37 0.42 Allowed 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 128.157 2.583 . . . . 0.0 108.912 -177.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -138.01 146.6 43.27 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.793 0.837 . . . . 0.0 112.925 -177.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 6.6 m170 -109.2 131.26 55.24 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.033 1.733 . . . . 0.0 111.537 169.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -114.06 105.1 12.81 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 126.706 2.002 . . . . 0.0 107.762 -176.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 38.2 p -115.1 133.14 56.3 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 -168.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 15.4 t -96.25 104.71 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 126.772 2.029 . . . . 0.0 106.91 168.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 95.8 t -74.52 114.8 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 124.537 1.135 . . . . 0.0 108.742 177.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 10.1 mpt_? 55.34 84.96 0.07 Allowed 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 126.257 1.823 . . . . 0.0 111.317 -173.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -73.76 118.23 16.46 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.744 0.817 . . . . 0.0 111.213 178.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 9.4 mpt_? -85.82 159.86 19.61 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.41 1.484 . . . . 0.0 109.383 171.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 17.1 mmm180 -49.2 -39.17 28.53 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 120.937 -1.102 . . . . 0.0 113.011 172.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -67.36 -10.07 47.55 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 178.011 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -84.6 -8.45 58.89 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 120.107 1.321 . . . . 0.0 112.871 172.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.4 m -64.35 136.69 57.38 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 120.155 -1.59 . . . . 0.0 112.438 177.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 155.24 -166.74 32.72 Favored Glycine 0 N--CA 1.468 0.786 0 C-N-CA 124.101 0.858 . . . . 0.0 113.016 -178.462 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.0 m -97.26 140.42 31.77 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.525 1.13 . . . . 0.0 110.803 -176.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -135.73 163.0 31.17 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.3 1.84 . . . . 0.0 112.175 -177.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -162.13 146.62 12.46 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.568 1.547 . . . . 0.0 112.589 171.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . 0.407 ' SG ' ' CD1' ' A' ' 37' ' ' PHE . 1.8 p -108.54 170.69 7.86 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.038 1.735 . . . . 0.0 111.026 176.247 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -175.35 142.37 6.16 Favored Glycine 0 N--CA 1.471 1.026 0 O-C-N 121.237 -0.915 . . . . 0.0 114.184 177.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -109.73 148.2 31.84 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.567 1.147 . . . . 0.0 112.765 -176.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 21.3 tt -138.01 143.7 32.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 126.667 1.987 . . . . 0.0 110.078 177.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.7 m -67.5 161.56 25.2 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.871 0.868 . . . . 0.0 112.835 176.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -59.02 -25.74 63.94 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 115.223 1.564 . . . . 0.0 115.223 178.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -81.73 148.13 60.76 Favored Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 124.876 1.27 . . . . 0.0 112.52 -174.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -69.91 -24.97 28.4 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 123.261 2.64 . . . . 0.0 114.107 -171.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.3 -0.97 30.89 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.84 1.422 . . . . 0.0 114.84 178.517 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.79 173.95 5.71 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.512 1.525 . . . . 0.0 113.196 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 53.8 tp60 -134.99 143.84 47.05 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.114 1.766 . . . . 0.0 109.171 179.041 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 53.7 mt -72.45 114.84 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 170.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -85.13 112.74 20.96 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.396 1.079 . . . . 0.0 111.027 -178.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -90.67 158.88 16.68 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.033 1.733 . . . . 0.0 112.048 -177.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 4.9 t -145.98 -166.85 2.57 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.994 0.918 . . . . 0.0 111.799 169.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.88 136.55 57.03 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.727 1.211 . . . . 0.0 113.094 -172.685 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 80.0 mtt85 -72.43 146.33 47.03 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.709 0.804 . . . . 0.0 111.529 -177.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -120.78 135.58 55.12 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.064 1.745 . . . . 0.0 110.688 -176.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -104.42 139.28 39.59 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.341 1.056 . . . . 0.0 111.728 -175.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 52.5 tp -109.62 127.91 54.86 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.8 1.64 . . . . 0.0 109.659 171.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 60.7 ttt85 -118.25 119.29 34.21 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.678 1.591 . . . . 0.0 109.179 170.127 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 43.6 t -102.0 123.15 55.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 171.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 68.6 p -99.0 145.47 27.04 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.566 1.546 . . . . 0.0 109.208 175.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -66.43 141.81 57.8 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 121.54 -0.725 . . . . 0.0 111.754 -175.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 . . . . . 0 N--CA 1.468 0.444 0 C-N-CA 124.186 0.994 . . . . 0.0 110.598 -179.033 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 15.3 t . . . . . 0 N--CA 1.476 0.861 0 CA-C-O 120.973 0.416 . . . . 0.0 111.639 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.404 ' CE1' ' HB2' ' A' ' 123' ' ' CYS . 1.9 m-85 -125.0 136.61 53.89 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.405 1.482 . . . . 0.0 110.714 -169.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 88.7 p -140.96 157.24 67.72 Favored Pre-proline 0 CA--C 1.548 0.894 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 177.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -70.37 160.59 89.59 Favored 'Cis proline' 0 C--N 1.352 0.716 0 CA-C-N 119.0 0.679 . . . . 0.0 110.887 -11.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.46 -30.71 69.84 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 172.284 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 49.8 tp -140.32 120.68 14.0 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.569 1.548 . . . . 0.0 109.358 171.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 61.0 tp -102.83 127.02 50.17 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.45 1.5 . . . . 0.0 109.171 172.129 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.6 t -109.7 124.9 66.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 123.902 0.881 . . . . 0.0 108.811 171.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.2 m -127.17 169.91 17.88 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 124.639 1.176 . . . . 0.0 111.551 172.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 94.5 m -100.66 147.28 26.16 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.043 1.337 . . . . 0.0 110.058 173.101 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -59.27 126.6 28.33 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.178 0.991 . . . . 0.0 111.823 -174.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 91.65 -2.84 77.7 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 125.993 1.759 . . . . 0.0 114.473 -174.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 38.3 t0 -83.35 156.84 22.8 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.841 1.821 . . . . 0.0 112.004 173.267 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -79.21 123.75 27.7 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.567 0.747 . . . . 0.0 109.806 170.175 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -102.66 129.4 49.24 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 117.68 -1.152 . . . . 0.0 110.567 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 31.3 m -132.79 129.65 38.84 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 119.377 0.99 . . . . 0.0 112.222 -177.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -106.21 159.62 15.96 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 127.625 2.37 . . . . 0.0 110.731 169.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 85.9 m -109.76 134.72 51.7 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.5 1.52 . . . . 0.0 109.108 170.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 64.2 m -131.55 125.74 33.09 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.981 1.312 . . . . 0.0 110.237 172.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 91.2 p -104.29 148.17 26.67 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.099 0.96 . . . . 0.0 110.817 175.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 . . . . . 0 N--CA 1.466 0.325 0 C-N-CA 124.852 1.261 . . . . 0.0 112.347 178.056 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 35.0 p90 . . . . . 0 CA--C 1.543 0.688 0 CA-C-O 120.42 0.152 . . . . 0.0 111.318 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 50.6 t -95.87 124.34 48.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 N-CA-C 107.559 -1.274 . . . . 0.0 107.559 170.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -99.33 141.76 31.68 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 126.655 1.982 . . . . 0.0 108.896 177.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -141.96 154.91 45.39 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.932 1.693 . . . . 0.0 111.258 -175.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 20.3 t90 -128.2 143.0 51.0 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.944 1.298 . . . . 0.0 111.395 175.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -138.13 148.3 44.79 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.818 1.247 . . . . 0.0 114.164 -170.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 53.5 ttt-85 -109.19 143.19 38.93 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.234 1.414 . . . . 0.0 109.65 168.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 85.7 mmm -75.38 135.07 40.82 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 118.333 0.515 . . . . 0.0 111.368 173.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.2 p -85.7 165.64 34.06 Favored Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 123.478 0.711 . . . . 0.0 112.429 172.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -58.62 -28.31 85.65 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 123.45 2.767 . . . . 0.0 113.498 170.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.7 m -83.52 0.96 44.24 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.874 1.27 . . . . 0.0 113.277 175.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 74.05 21.71 2.51 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 127.613 2.365 . . . . 0.0 113.429 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 18.7 mm100 -87.42 -178.96 6.28 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.71 0.804 . . . . 0.0 110.393 169.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.8 p -126.83 119.35 26.62 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.94 1.696 . . . . 0.0 109.388 -173.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -104.07 128.62 51.7 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.717 0.807 . . . . 0.0 111.199 -179.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -76.53 127.62 33.18 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.045 0.938 . . . . 0.0 112.065 -172.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 66.2 mt -106.75 -44.35 4.47 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 125.343 1.457 . . . . 0.0 112.406 -169.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -166.97 169.71 12.75 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.479 1.912 . . . . 0.0 110.432 -176.1 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.56 165.77 32.18 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.645 1.178 . . . . 0.0 112.76 -171.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 75.0 t80 -147.49 123.0 5.29 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 125.388 1.475 . . . . 0.0 110.533 170.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo . . . . . 0 C--N 1.351 0.665 0 CA-C-N 120.126 1.081 . . . . 0.0 111.94 -10.68 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 48.5 mtp180 . . . . . 0 N--CA 1.473 0.701 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -88.63 142.38 27.74 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.368 1.067 . . . . 0.0 111.388 176.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 48.6 mtm180 -143.0 154.16 43.71 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.054 1.341 . . . . 0.0 112.79 -172.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 37.6 t -126.49 134.05 67.25 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 126.392 1.877 . . . . 0.0 108.702 168.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 95.3 m -123.91 126.06 45.71 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.262 1.425 . . . . 0.0 108.666 169.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 6.8 pm0 -83.62 141.56 31.45 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.322 1.049 . . . . 0.0 111.146 174.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 18.1 mt -87.81 156.25 52.72 Favored Pre-proline 0 CA--C 1.542 0.668 0 C-N-CA 123.685 0.794 . . . . 0.0 111.526 178.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -66.43 -4.61 11.05 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 123.361 2.708 . . . . 0.0 114.148 176.163 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -71.83 -10.5 59.87 Favored 'General case' 0 CA--C 1.551 1.015 0 CA-C-N 119.895 1.225 . . . . 0.0 113.281 171.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 92.15 -19.43 49.58 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 125.775 1.655 . . . . 0.0 116.024 169.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 11.9 ptp180 -154.63 73.65 0.91 Allowed 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 122.736 1.255 . . . . 0.0 110.842 173.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -167.43 144.77 4.53 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 128.7 2.8 . . . . 0.0 107.834 -176.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -146.66 147.52 31.11 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 113.82 1.044 . . . . 0.0 113.82 -168.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 51.6 m170 -109.0 127.93 54.51 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.827 1.651 . . . . 0.0 109.758 168.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.1 mpt? -113.52 126.74 55.65 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 126.253 1.821 . . . . 0.0 108.592 -176.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 93.7 p -142.67 149.06 38.38 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 116.841 2.163 . . . . 0.0 116.841 -171.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 11.1 t -103.41 122.44 55.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 126.849 2.059 . . . . 0.0 108.684 174.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 86.3 t -73.59 120.98 23.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 124.382 1.073 . . . . 0.0 109.675 169.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 49.3 72.61 0.29 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 126.006 1.722 . . . . 0.0 111.807 172.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.58 135.4 52.85 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.367 1.067 . . . . 0.0 111.954 -172.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -102.88 157.8 16.72 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 126.312 1.845 . . . . 0.0 109.937 175.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 74.9 mtm180 -52.47 -30.39 29.59 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 175.388 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 32.1 t30 -63.14 -24.74 68.03 Favored 'General case' 0 CA--C 1.551 1.009 0 N-CA-C 114.927 1.455 . . . . 0.0 114.927 173.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -74.82 -21.19 59.42 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 119.811 1.187 . . . . 0.0 112.87 -179.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 17.6 m -57.65 131.86 51.53 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.552 1.141 . . . . 0.0 113.198 -175.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 156.64 -165.92 33.17 Favored Glycine 0 CA--C 1.529 0.961 0 C-N-CA 124.523 1.059 . . . . 0.0 113.157 -172.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.4 m -93.25 143.01 26.68 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.058 1.343 . . . . 0.0 111.139 -175.284 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 61.9 m-85 -140.81 157.3 45.59 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.702 1.601 . . . . 0.0 111.515 -177.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.6 pp -154.98 156.24 35.65 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.285 1.034 . . . . 0.0 111.857 173.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . 0.404 ' HB2' ' CE1' ' A' ' 37' ' ' PHE . 79.6 m -101.77 162.38 12.95 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.002 0.921 . . . . 0.0 110.741 173.539 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -155.11 158.83 28.65 Favored Glycine 0 N--CA 1.47 0.929 0 O-C-N 121.473 -0.767 . . . . 0.0 112.98 173.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -146.98 156.7 43.26 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 117.952 0.876 . . . . 0.0 112.766 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.0 tt -146.98 134.39 14.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 124.829 1.252 . . . . 0.0 110.983 -175.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 48.2 t -61.84 158.18 16.52 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.045 0.938 . . . . 0.0 113.068 178.666 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 68.4 mt -72.95 -12.61 61.01 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.26 1.024 . . . . 0.0 112.949 176.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -67.43 143.95 97.56 Favored Pre-proline 0 CA--C 1.554 1.1 0 C-N-CA 124.451 1.1 . . . . 0.0 112.583 177.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_exo -57.33 -30.77 88.94 Favored 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 123.624 2.883 . . . . 0.0 114.846 177.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -87.93 7.23 31.89 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 124.687 1.195 . . . . 0.0 114.163 -176.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.78 165.99 14.06 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.928 1.291 . . . . 0.0 114.319 -175.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 31.2 tt0 -146.49 149.88 34.5 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.215 1.806 . . . . 0.0 109.116 178.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 56.1 mt -73.39 124.64 30.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 123.377 0.671 . . . . 0.0 111.112 -176.002 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -84.81 142.99 29.38 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.037 1.735 . . . . 0.0 110.904 172.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -142.79 158.89 43.18 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.978 1.711 . . . . 0.0 110.638 -175.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 5.5 t -144.12 -171.57 3.59 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.424 1.09 . . . . 0.0 111.947 175.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -63.25 125.23 23.42 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.182 1.393 . . . . 0.0 110.585 -176.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -65.56 163.77 15.48 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 -173.15 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.96 168.21 10.27 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.021 2.129 . . . . 0.0 111.317 175.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -131.52 142.95 50.06 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.883 1.273 . . . . 0.0 111.623 177.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 66.1 tp -109.87 133.81 52.75 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 125.954 1.701 . . . . 0.0 109.883 170.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 72.0 ttt180 -123.94 120.14 31.64 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.676 1.59 . . . . 0.0 108.986 169.055 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 44.4 t -104.19 120.34 54.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 170.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 67.2 p -98.22 148.75 23.28 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.234 1.814 . . . . 0.0 109.521 177.452 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -64.02 151.01 44.07 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.313 -0.867 . . . . 0.0 113.226 -172.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 48.3 ttt85 . . . . . 0 C--O 1.236 0.359 0 C-N-CA 123.953 0.901 . . . . 0.0 108.638 -173.935 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 6.0 t . . . . . 0 N--CA 1.471 0.622 0 CA-C-O 120.502 0.192 . . . . 0.0 111.44 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -160.28 157.86 28.82 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 125.943 1.697 . . . . 0.0 113.243 176.708 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 95.1 p -140.78 158.74 64.72 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 125.163 1.385 . . . . 0.0 112.568 174.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -73.48 160.88 95.18 Favored 'Cis proline' 0 C--N 1.351 0.686 0 CA-C-N 118.485 0.495 . . . . 0.0 111.311 -9.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.75 -30.58 71.59 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 171.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 45.9 tp -136.79 117.67 14.17 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.947 1.699 . . . . 0.0 109.046 171.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.2 tp -100.69 127.36 47.12 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.43 1.492 . . . . 0.0 109.439 174.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.0 t -109.99 124.2 66.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 123.979 0.911 . . . . 0.0 108.809 172.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.4 m -127.86 167.06 23.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 124.916 1.286 . . . . 0.0 111.595 172.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 67.1 m -93.4 148.49 22.02 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.485 1.114 . . . . 0.0 110.145 174.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -53.93 119.9 5.64 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.885 1.274 . . . . 0.0 111.708 177.359 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 94.59 -3.28 68.22 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 126.104 1.812 . . . . 0.0 114.886 -177.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -88.83 155.18 19.7 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 119.281 1.54 . . . . 0.0 111.582 174.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -80.82 134.61 35.81 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.292 -0.88 . . . . 0.0 111.437 173.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -107.22 131.75 53.83 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.13 1.772 . . . . 0.0 110.592 178.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 28.6 m -132.75 125.09 29.37 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.846 0.858 . . . . 0.0 111.302 -179.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -101.49 153.23 19.89 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.249 1.42 . . . . 0.0 110.357 169.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 66.9 m -117.05 117.67 30.27 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.213 1.005 . . . . 0.0 110.166 178.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 21.6 m -101.0 151.12 22.16 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.699 1.2 . . . . 0.0 113.157 169.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 70.3 m -127.05 115.42 19.17 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.01 1.324 . . . . 0.0 109.207 174.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 . . . . . 0 N--CA 1.468 0.471 0 C-N-CA 126.291 1.837 . . . . 0.0 110.083 -178.27 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 24.4 p90 . . . . . 0 CA--C 1.538 0.496 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 45.7 t -110.85 134.0 54.53 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 C-N-CA 127.076 2.15 . . . . 0.0 107.847 171.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 30.8 tp -109.17 134.14 52.11 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.324 0.65 . . . . 0.0 110.087 169.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -124.96 148.98 48.13 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.505 1.522 . . . . 0.0 111.241 -169.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 34.6 t-105 -110.22 138.83 46.07 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.4 1.48 . . . . 0.0 111.665 175.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -132.99 146.03 51.4 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.1 1.36 . . . . 0.0 112.441 -177.07 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 38.5 ttp180 -91.7 136.59 33.02 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.693 1.597 . . . . 0.0 107.541 167.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 16.6 ttm -111.44 133.14 53.95 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.972 1.309 . . . . 0.0 110.206 -179.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 51.0 m -85.62 160.61 53.07 Favored Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 125.301 1.44 . . . . 0.0 112.391 179.046 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_exo -58.56 -26.39 78.46 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 124.237 3.291 . . . . 0.0 114.136 174.36 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.9 p -76.95 1.32 18.06 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.891 1.677 . . . . 0.0 113.643 174.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 30.5 m-80 69.81 20.98 6.59 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 127.635 2.374 . . . . 0.0 112.786 -176.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -85.84 169.85 12.94 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.637 0.775 . . . . 0.0 110.364 169.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.7 p -138.92 152.48 47.77 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.967 1.307 . . . . 0.0 111.974 -173.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -136.9 131.11 32.66 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.362 1.865 . . . . 0.0 110.296 -178.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -85.05 129.27 34.83 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.16 0.984 . . . . 0.0 111.96 -173.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 55.5 mt -107.44 -57.1 2.13 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.282 1.033 . . . . 0.0 110.892 -172.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -162.18 173.84 13.73 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.526 1.13 . . . . 0.0 111.286 -173.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.62 172.17 18.28 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.104 1.361 . . . . 0.0 111.639 -177.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 45.6 t80 -138.46 118.36 9.79 Favored Pre-proline 0 CA--C 1.546 0.791 0 CA-C-O 118.507 -0.759 . . . . 0.0 110.521 168.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo . . . . . 0 C--N 1.353 0.768 0 CA-C-N 119.375 0.813 . . . . 0.0 111.153 -8.8 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.3 ptm180 . . . . . 0 N--CA 1.468 0.461 0 N-CA-C 116.72 2.119 . . . . 0.0 116.72 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -103.63 117.23 33.93 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.831 1.252 . . . . 0.0 109.751 176.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 15.8 mmt180 -144.43 155.51 43.78 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.697 0.799 . . . . 0.0 112.277 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 31.1 t -126.56 140.39 49.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 C-N-CA 125.085 1.354 . . . . 0.0 110.582 176.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 96.3 m -130.63 134.28 46.84 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 125.474 1.509 . . . . 0.0 111.098 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -78.79 135.33 37.06 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.997 1.319 . . . . 0.0 109.967 169.519 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 21.5 mt -82.11 159.29 65.63 Favored Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 124.187 0.995 . . . . 0.0 112.386 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -64.2 -6.89 12.39 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 123.301 2.667 . . . . 0.0 114.287 174.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -73.85 -7.65 53.03 Favored 'General case' 0 CA--C 1.551 1.017 0 CA-C-N 120.022 1.283 . . . . 0.0 113.261 170.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 83.49 -14.07 43.03 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 125.518 1.532 . . . . 0.0 116.092 169.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.57 73.52 0.91 Allowed 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 123.103 1.43 . . . . 0.0 111.341 172.085 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -171.47 145.41 2.08 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 128.482 2.713 . . . . 0.0 108.186 -176.356 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -142.96 141.68 31.48 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -168.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 23.0 m170 -102.57 130.34 49.4 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.598 1.559 . . . . 0.0 110.806 169.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -114.77 111.54 21.4 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.974 1.71 . . . . 0.0 108.621 179.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 32.4 m -110.37 130.46 55.55 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.623 1.169 . . . . 0.0 112.935 -168.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 34.0 t -110.47 101.41 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 126.889 2.076 . . . . 0.0 107.112 168.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 70.9 t -74.32 133.87 30.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 123.785 0.834 . . . . 0.0 110.266 -178.361 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 39.1 ttm180 57.2 62.84 2.06 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.911 1.284 . . . . 0.0 110.737 172.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.41 135.38 47.22 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 124.475 1.11 . . . . 0.0 111.173 -175.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.98 167.31 10.49 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.29 1.436 . . . . 0.0 111.026 175.336 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 12.2 mtp180 -58.86 -23.02 60.26 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 113.915 1.079 . . . . 0.0 113.915 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -69.34 -21.98 63.79 Favored 'General case' 0 CA--C 1.553 1.07 0 N-CA-C 114.104 1.15 . . . . 0.0 114.104 170.501 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -77.23 -20.12 55.68 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 119.771 1.169 . . . . 0.0 113.565 174.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 49.1 m -57.29 129.22 40.8 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 119.86 1.209 . . . . 0.0 112.358 -178.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 154.55 -166.71 32.35 Favored Glycine 0 N--CA 1.471 0.991 0 C-N-CA 124.218 0.913 . . . . 0.0 113.421 -171.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.3 m -91.01 143.64 26.5 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.436 1.094 . . . . 0.0 110.998 -175.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -140.73 158.06 44.52 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.637 1.975 . . . . 0.0 110.619 176.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.4 pp -158.03 166.48 32.43 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 120.839 -1.163 . . . . 0.0 113.466 -178.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -114.19 135.89 53.55 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.226 1.81 . . . . 0.0 110.697 -174.585 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -138.99 130.37 4.83 Favored Glycine 0 N--CA 1.472 1.072 0 C-N-CA 123.997 0.808 . . . . 0.0 113.276 179.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -102.72 155.07 18.56 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.75 1.22 . . . . 0.0 112.725 -176.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 19.2 tt -155.93 144.52 12.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 125.339 1.455 . . . . 0.0 109.57 176.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 2.2 m -65.27 161.58 19.15 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 121.045 -1.035 . . . . 0.0 112.971 178.505 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 59.2 tp -60.58 -34.66 74.52 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.112 0.965 . . . . 0.0 112.154 169.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -66.83 127.88 93.64 Favored Pre-proline 0 CA--C 1.554 1.133 0 C-N-CA 124.481 1.112 . . . . 0.0 111.891 178.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -56.69 -24.59 55.59 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 124.108 3.205 . . . . 0.0 115.834 -178.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -70.6 -6.45 36.75 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 178.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.06 173.23 5.69 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.458 1.503 . . . . 0.0 114.103 -178.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -140.5 161.77 36.93 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.215 1.806 . . . . 0.0 109.668 174.481 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 28.4 mt -82.7 124.36 39.31 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 CA-C-O 121.174 0.511 . . . . 0.0 111.44 -169.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -91.41 127.31 36.8 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.342 1.857 . . . . 0.0 110.178 171.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -137.25 139.1 40.76 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.101 1.36 . . . . 0.0 111.041 -178.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 57.5 m -147.74 143.51 27.62 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.812 1.645 . . . . 0.0 110.063 171.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 42.6 mt 66.84 -178.55 0.21 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 126.978 2.111 . . . . 0.0 113.526 176.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.4 145.73 20.63 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.243 1.817 . . . . 0.0 110.572 169.656 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.86 165.09 13.48 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.829 1.652 . . . . 0.0 110.897 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -127.35 136.09 51.41 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 124.392 1.077 . . . . 0.0 110.23 -171.3 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 62.5 tp -110.36 131.89 54.66 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 125.554 1.541 . . . . 0.0 109.598 174.117 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 70.8 ttt180 -122.86 120.97 35.06 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.717 1.607 . . . . 0.0 109.566 170.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 28.7 t -104.41 118.22 51.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 C-N-CA 124.429 1.092 . . . . 0.0 109.026 170.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 71.9 p -98.5 155.71 17.13 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.738 1.615 . . . . 0.0 110.935 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -64.45 141.24 58.84 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 121.61 0.719 . . . . 0.0 112.347 -177.219 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 26.0 ttp-105 . . . . . 0 N--CA 1.466 0.362 0 C-N-CA 125.133 1.373 . . . . 0.0 110.166 179.279 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 91.8 m . . . . . 0 N--CA 1.47 0.564 0 CA-C-O 121.152 0.501 . . . . 0.0 110.463 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 50.6 t80 -145.47 118.88 9.0 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.225 1.81 . . . . 0.0 109.27 175.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 71.7 m -140.77 159.97 60.48 Favored Pre-proline 0 N--CA 1.477 0.886 0 C-N-CA 124.306 1.042 . . . . 0.0 113.352 -168.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -70.03 156.69 93.39 Favored 'Cis proline' 0 C--N 1.354 0.832 0 CA-C-N 119.723 0.937 . . . . 0.0 111.415 -4.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.03 -21.92 64.06 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 176.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 51.5 tp -143.68 121.68 12.09 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.311 1.444 . . . . 0.0 108.876 169.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 49.7 tp -111.12 126.96 55.39 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.536 1.534 . . . . 0.0 109.264 173.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 40.3 t -115.78 120.08 63.74 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 124.219 1.008 . . . . 0.0 108.927 176.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 26.9 m -123.64 166.97 18.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 125.57 1.548 . . . . 0.0 111.72 174.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 24.4 m -90.95 151.11 21.21 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.796 1.238 . . . . 0.0 110.701 174.227 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -51.73 124.87 13.42 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.246 1.418 . . . . 0.0 111.56 174.069 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.57 -1.36 88.9 Favored Glycine 0 CA--C 1.533 1.213 0 C-N-CA 125.487 1.517 . . . . 0.0 114.849 -177.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -88.67 162.13 16.47 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 119.421 1.61 . . . . 0.0 111.808 175.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -89.89 136.44 33.04 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.192 0.997 . . . . 0.0 110.65 176.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -116.79 135.95 53.35 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.255 1.422 . . . . 0.0 110.95 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 22.4 m -132.72 124.26 27.83 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 118.945 0.793 . . . . 0.0 111.869 178.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -100.79 159.56 15.09 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.648 1.579 . . . . 0.0 110.239 169.009 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 35.9 m -116.22 131.36 56.96 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.154 1.381 . . . . 0.0 110.38 177.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 50.3 t -117.96 143.26 46.52 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.457 1.903 . . . . 0.0 112.533 176.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 68.7 m -142.82 131.12 22.11 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.602 1.161 . . . . 0.0 111.417 177.158 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 . . . . . 0 N--CA 1.474 0.75 0 C-N-CA 126.641 1.977 . . . . 0.0 113.126 177.588 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 51.0 p90 . . . . . 0 CA--C 1.539 0.522 0 CA-C-O 120.606 0.241 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 46.0 t -107.87 136.07 44.46 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 124.887 1.275 . . . . 0.0 108.715 174.202 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -123.25 123.6 41.13 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.313 1.445 . . . . 0.0 108.776 -177.204 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 9.9 m-80 -123.48 152.51 41.63 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.559 1.543 . . . . 0.0 113.153 -167.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 12.6 t90 -117.51 135.71 53.74 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.836 1.654 . . . . 0.0 111.645 175.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -130.69 147.98 52.42 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.239 1.416 . . . . 0.0 113.481 -178.333 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 40.3 ttp180 -100.29 137.26 38.96 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 126.543 1.937 . . . . 0.0 107.331 167.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 16.0 ttm -112.02 134.84 53.33 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.321 1.448 . . . . 0.0 110.423 -175.362 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.1 m -91.4 157.5 42.24 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 124.82 1.248 . . . . 0.0 112.143 178.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -56.46 -31.48 85.99 Favored 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 124.209 3.273 . . . . 0.0 114.009 176.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.4 m -76.93 9.77 2.71 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.209 1.404 . . . . 0.0 113.624 177.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 64.2 t30 69.69 26.29 4.97 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 127.104 2.162 . . . . 0.0 112.908 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -94.45 168.36 10.92 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.245 1.018 . . . . 0.0 110.479 172.076 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.0 p -138.81 152.49 47.92 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.069 1.348 . . . . 0.0 111.536 -178.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -133.62 129.93 37.6 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 126.584 1.954 . . . . 0.0 110.105 -178.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -82.95 129.05 34.98 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.863 0.865 . . . . 0.0 111.389 -175.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 55.3 mt -104.21 -50.02 3.45 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.173 0.989 . . . . 0.0 111.963 -171.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -170.25 169.52 7.69 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.611 1.964 . . . . 0.0 109.675 -175.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.59 153.27 22.81 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.872 1.269 . . . . 0.0 110.926 -176.074 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -105.48 135.61 19.34 Favored Pre-proline 0 CA--C 1.547 0.846 0 C-N-CA 123.972 0.909 . . . . 0.0 110.994 174.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo . . . . . 0 C--N 1.352 0.727 0 CA-C-N 119.395 0.819 . . . . 0.0 111.102 -6.386 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.4 ptp180 . . . . . 0 N--CA 1.477 0.885 0 N-CA-C 114.71 1.374 . . . . 0.0 114.71 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -103.18 147.98 26.34 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.209 1.404 . . . . 0.0 111.968 -172.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -143.24 151.98 41.19 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.852 1.661 . . . . 0.0 111.989 172.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 46.2 t -121.32 128.56 75.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 124.414 1.085 . . . . 0.0 110.139 169.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 91.5 m -122.96 132.4 54.14 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.137 1.375 . . . . 0.0 110.312 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 24.8 tt0 -86.78 139.08 31.06 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.978 0.911 . . . . 0.0 110.722 173.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 28.7 mt -92.46 158.29 38.86 Favored Pre-proline 0 CA--C 1.546 0.794 0 C-N-CA 124.897 1.279 . . . . 0.0 111.808 177.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -67.72 -1.81 7.42 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 123.648 2.899 . . . . 0.0 114.235 175.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 25.3 m120 -64.81 -16.78 63.54 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 172.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 105.44 -34.0 6.11 Favored Glycine 0 N--CA 1.474 1.216 0 C-N-CA 126.127 1.822 . . . . 0.0 114.293 170.009 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 35.0 ptt180 -154.58 73.59 0.91 Allowed 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 123.098 1.428 . . . . 0.0 110.813 169.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -151.83 137.69 18.05 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 127.761 2.425 . . . . 0.0 106.958 179.32 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 -139.81 139.52 36.39 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -167.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -103.55 130.68 51.0 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.836 1.254 . . . . 0.0 111.71 170.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -107.04 105.4 15.4 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 127.276 2.23 . . . . 0.0 108.966 179.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 30.2 t -107.6 123.92 49.19 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.727 0.811 . . . . 0.0 112.705 -170.23 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 12.1 t -95.25 119.86 43.88 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 126.355 1.862 . . . . 0.0 106.928 169.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 81.3 t -91.43 128.54 43.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 123.558 0.743 . . . . 0.0 109.876 175.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 69.9 ttt180 53.46 60.55 3.63 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.911 1.684 . . . . 0.0 111.604 174.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.06 134.67 52.32 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.735 0.814 . . . . 0.0 111.362 -172.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.22 167.28 10.68 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.615 1.566 . . . . 0.0 110.261 -179.439 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 88.4 mtm-85 -56.88 -27.75 60.94 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 120.96 -1.088 . . . . 0.0 113.205 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -56.43 -27.77 57.58 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 126.673 1.989 . . . . 0.0 114.527 169.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 -86.95 -14.47 41.7 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 -175.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 52.7 m -59.36 129.88 44.19 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.793 1.179 . . . . 0.0 112.066 175.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 164.46 -159.7 32.67 Favored Glycine 0 N--CA 1.472 1.09 0 O-C-N 121.792 -0.567 . . . . 0.0 113.727 -176.2 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 8.5 m -100.65 144.42 29.65 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.107 1.363 . . . . 0.0 109.983 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 -143.62 155.43 44.26 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.653 1.581 . . . . 0.0 111.551 -178.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.3 pp -157.12 164.91 37.35 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.891 1.276 . . . . 0.0 112.525 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 21.2 t -113.78 155.51 25.52 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.282 1.433 . . . . 0.0 111.052 -179.382 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -154.67 144.23 10.89 Favored Glycine 0 N--CA 1.471 0.995 0 O-C-N 121.304 -0.873 . . . . 0.0 114.297 177.076 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -132.2 158.2 42.35 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -173.562 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 17.0 tt -152.34 134.97 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 125.316 1.446 . . . . 0.0 111.17 178.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 60.9 m -72.9 161.64 30.46 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.108 1.363 . . . . 0.0 113.417 177.324 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -59.73 -21.56 60.85 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 116.122 1.897 . . . . 0.0 116.122 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -72.92 147.73 88.84 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 124.399 1.08 . . . . 0.0 112.653 -173.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -67.22 -20.2 49.67 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.085 2.523 . . . . 0.0 112.75 176.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 82.7 tttt -75.82 -13.07 60.28 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 124.801 1.241 . . . . 0.0 113.558 174.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.11 161.64 26.45 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.533 1.133 . . . . 0.0 113.033 -177.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -147.98 152.76 38.04 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.914 1.686 . . . . 0.0 108.631 175.148 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 36.2 mt -71.69 115.39 11.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 O-C-N 121.695 -0.628 . . . . 0.0 110.63 -176.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 48.1 tttp -90.63 141.8 28.41 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.829 1.252 . . . . 0.0 109.661 169.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -110.87 151.01 28.35 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.69 1.196 . . . . 0.0 111.96 -175.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 59.8 p -86.4 176.95 7.6 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.815 1.246 . . . . 0.0 113.275 174.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 99.1 mt -68.65 139.95 55.47 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 166.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.63 148.97 33.02 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 -178.33 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -123.76 169.64 11.32 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 127.182 2.193 . . . . 0.0 111.243 177.266 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -119.74 141.7 49.2 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.981 1.312 . . . . 0.0 112.37 179.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 52.2 tp -109.69 137.8 46.98 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 125.817 1.647 . . . . 0.0 109.752 169.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -128.84 125.01 36.81 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.604 1.562 . . . . 0.0 110.31 173.078 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 40.6 t -108.13 112.44 40.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 C-N-CA 125.224 1.409 . . . . 0.0 108.597 169.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 64.6 p -91.59 154.93 18.72 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.573 1.549 . . . . 0.0 110.241 177.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -58.88 151.0 22.63 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.754 0.822 . . . . 0.0 112.693 -175.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 22.9 tpt180 . . . . . 0 N--CA 1.466 0.361 0 C-N-CA 124.895 1.278 . . . . 0.0 109.893 -176.549 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.0 t . . . . . 0 N--CA 1.471 0.585 0 CA-C-O 121.446 0.641 . . . . 0.0 111.568 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -134.34 125.66 28.08 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.964 1.706 . . . . 0.0 109.704 -173.073 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 91.0 p -140.87 157.49 67.34 Favored Pre-proline 0 CA--C 1.549 0.909 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 -169.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -68.32 162.17 80.04 Favored 'Cis proline' 0 C--N 1.355 0.92 0 CA-C-N 119.474 0.848 . . . . 0.0 111.862 -4.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.82 -26.52 68.17 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 176.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 48.0 tp -141.81 123.28 14.95 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.493 1.517 . . . . 0.0 108.889 170.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 53.7 tp -108.79 125.1 51.58 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.3 1.44 . . . . 0.0 109.34 172.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.2 t -110.4 121.39 63.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 124.165 0.986 . . . . 0.0 108.967 175.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.5 m -125.46 172.15 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 C-N-CA 125.009 1.323 . . . . 0.0 111.972 173.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 9.5 m -96.94 151.86 19.28 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 125.789 1.636 . . . . 0.0 110.612 176.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -45.71 122.81 3.9 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.536 1.134 . . . . 0.0 112.525 169.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.57 3.21 88.53 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 125.502 1.525 . . . . 0.0 114.508 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 31.2 t0 -90.4 159.12 16.75 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 119.393 1.597 . . . . 0.0 112.375 177.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 70.2 m-20 -88.96 117.57 28.07 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.345 1.058 . . . . 0.0 110.369 176.506 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -99.19 130.07 45.47 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.856 1.262 . . . . 0.0 110.547 178.22 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 60.9 m -131.92 127.2 35.93 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 119.347 0.976 . . . . 0.0 111.41 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -101.3 158.44 16.05 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.135 1.774 . . . . 0.0 110.474 172.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 37.5 m -106.69 131.23 54.06 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.322 1.449 . . . . 0.0 109.28 173.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 48.5 t -111.69 129.74 56.01 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.902 1.281 . . . . 0.0 110.893 169.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 8.4 t -122.46 131.22 53.76 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.537 1.135 . . . . 0.0 108.666 173.078 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 41.3 p90 . . . . . 0 N--CA 1.47 0.559 0 C-N-CA 124.442 1.097 . . . . 0.0 112.291 -176.188 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 28.5 p90 . . . . . 0 CA--C 1.537 0.472 0 N-CA-C 114.718 1.377 . . . . 0.0 114.718 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 64.5 t -105.88 129.48 58.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 126.529 1.932 . . . . 0.0 107.017 167.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 51.3 tp -99.32 143.21 29.84 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.94 1.296 . . . . 0.0 109.453 173.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -138.62 154.56 48.67 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.507 1.523 . . . . 0.0 111.032 -176.706 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 14.9 t90 -128.74 135.66 49.51 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.019 1.328 . . . . 0.0 110.744 175.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 57.8 m-85 -129.06 148.9 51.05 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.95 1.3 . . . . 0.0 113.596 -174.001 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 55.3 ttt-85 -109.03 142.99 38.92 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.694 1.598 . . . . 0.0 108.257 167.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 30.1 mtp -85.77 145.88 27.04 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 118.948 0.794 . . . . 0.0 112.509 176.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 69.1 m -94.07 157.66 37.42 Favored Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 125.494 1.518 . . . . 0.0 111.37 173.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -66.71 -16.72 51.2 Favored 'Trans proline' 0 CA--C 1.54 0.825 0 C-N-CA 123.256 2.637 . . . . 0.0 113.383 176.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 40.7 p -76.98 -1.15 27.26 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.118 1.767 . . . . 0.0 113.783 169.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 70.15 20.98 6.15 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 127.849 2.46 . . . . 0.0 113.08 -172.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -88.53 -172.68 3.85 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.423 1.089 . . . . 0.0 110.175 168.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.0 p -142.76 151.49 41.29 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.83 1.652 . . . . 0.0 110.728 -176.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -128.96 133.41 47.8 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 124.645 1.178 . . . . 0.0 111.616 174.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -78.15 129.22 34.9 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.43 1.092 . . . . 0.0 111.472 -179.158 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 57.9 mt -105.57 -47.75 3.84 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 125.575 1.55 . . . . 0.0 112.345 -169.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -162.04 170.02 19.99 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 127.072 2.149 . . . . 0.0 109.68 -174.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.55 171.52 19.5 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.41 1.084 . . . . 0.0 112.042 -172.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -146.79 111.45 4.17 Favored Pre-proline 0 CA--C 1.546 0.799 0 C-N-CA 125.026 1.33 . . . . 0.0 109.462 171.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo . . . . . 0 CA--C 1.54 0.794 0 CA-C-N 119.641 0.908 . . . . 0.0 111.721 -5.468 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 82.0 mtt85 . . . . . 0 N--CA 1.471 0.6 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -91.34 131.56 36.76 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 -164.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 21.4 ttm-85 -144.49 143.99 31.13 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.497 1.119 . . . . 0.0 112.352 169.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 91.8 t -107.3 131.31 57.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 126.638 1.975 . . . . 0.0 109.035 173.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 90.0 m -130.58 133.27 46.05 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.32 1.448 . . . . 0.0 110.686 -178.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -79.08 141.79 37.04 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.165 0.986 . . . . 0.0 112.318 178.095 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 26.6 mt -92.88 162.4 28.95 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 123.543 0.737 . . . . 0.0 111.628 171.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -58.04 -21.03 48.32 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 123.924 3.083 . . . . 0.0 114.093 172.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 41.1 t30 -64.99 -13.83 58.77 Favored 'General case' 0 CA--C 1.552 1.02 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 -179.325 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 83.08 -34.01 2.86 Favored Glycine 0 N--CA 1.475 1.281 0 C-N-CA 125.882 1.706 . . . . 0.0 114.649 171.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 23.0 ptt180 -130.17 73.5 1.54 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 125.391 1.476 . . . . 0.0 109.523 169.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -178.78 140.68 0.18 Allowed 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 127.569 2.348 . . . . 0.0 109.338 -177.364 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -147.3 153.64 39.97 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.316 1.046 . . . . 0.0 112.79 -168.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -106.91 139.51 41.21 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.609 1.564 . . . . 0.0 111.464 169.167 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.4 mpt? -120.1 106.11 11.66 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 126.471 1.908 . . . . 0.0 109.05 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 77.8 p -108.75 128.26 54.72 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.872 0.869 . . . . 0.0 113.333 -172.042 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 32.5 t -100.14 99.07 7.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 127.859 2.463 . . . . 0.0 106.846 169.107 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 29.2 m -74.46 139.77 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 O-C-N 121.749 -0.595 . . . . 0.0 111.861 178.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 32.2 ttm180 53.84 49.51 18.96 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.81 1.644 . . . . 0.0 112.626 170.265 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.5 148.56 50.4 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.195 0.998 . . . . 0.0 112.778 -171.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -124.32 164.73 19.0 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.836 1.254 . . . . 0.0 111.856 178.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 86.5 mtm-85 -52.58 -37.21 57.58 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.401 1.081 . . . . 0.0 113.557 -172.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -48.43 -34.31 10.77 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.859 2.064 . . . . 0.0 114.599 171.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -81.51 -13.91 57.57 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.504 1.122 . . . . 0.0 112.738 -168.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.8 m -59.92 131.1 49.82 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.307 1.043 . . . . 0.0 112.474 179.127 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 161.46 -166.83 36.08 Favored Glycine 0 N--CA 1.473 1.134 0 C-N-CA 124.418 1.008 . . . . 0.0 113.622 -171.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 7.6 m -96.62 140.0 31.88 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.28 1.032 . . . . 0.0 110.816 -175.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 64.8 m-85 -136.44 156.73 48.21 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.004 1.722 . . . . 0.0 111.704 179.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -156.59 150.89 25.34 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 176.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 52.1 t -95.04 151.62 19.03 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 126.486 1.914 . . . . 0.0 111.437 177.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -164.1 138.07 5.09 Favored Glycine 0 N--CA 1.472 1.069 0 O-C-N 121.424 -0.797 . . . . 0.0 114.538 172.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -121.27 159.2 26.48 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.474 1.11 . . . . 0.0 112.644 -178.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 21.2 tt -147.57 135.9 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 125.586 1.554 . . . . 0.0 111.249 -176.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 36.8 t -72.25 161.17 31.23 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.044 0.937 . . . . 0.0 113.46 -178.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 65.7 mt -82.83 -11.45 58.23 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.735 1.214 . . . . 0.0 112.693 169.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -68.73 157.23 89.17 Favored Pre-proline 0 CA--C 1.551 1.018 0 C-N-CA 125.067 1.347 . . . . 0.0 112.358 176.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -66.97 -21.82 49.18 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 122.968 2.445 . . . . 0.0 113.192 178.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.52 6.28 15.3 Favored 'General case' 0 CA--C 1.551 0.994 0 N-CA-C 114.817 1.414 . . . . 0.0 114.817 177.149 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -62.62 159.22 16.44 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.755 1.391 . . . . 0.0 114.755 -171.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -157.23 149.13 22.5 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 127.091 2.156 . . . . 0.0 108.29 -176.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 11.7 mm -71.44 107.6 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 171.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -82.31 88.42 6.54 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.954 0.902 . . . . 0.0 109.308 173.249 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -69.97 134.68 48.61 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.116 0.966 . . . . 0.0 111.37 -178.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 68.7 m -84.74 155.95 21.65 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.155 0.982 . . . . 0.0 112.338 171.457 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -59.82 128.26 36.02 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 121.694 -0.629 . . . . 0.0 109.426 169.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -69.67 157.99 36.21 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 114.371 1.249 . . . . 0.0 114.371 -170.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -127.77 164.41 22.21 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.791 2.037 . . . . 0.0 111.639 176.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -116.24 140.35 49.41 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.767 1.227 . . . . 0.0 111.542 177.354 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 62.1 tp -106.97 134.63 49.83 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.983 1.713 . . . . 0.0 109.563 169.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 59.7 ttt85 -126.92 122.67 35.25 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 125.652 1.581 . . . . 0.0 109.786 170.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 36.4 t -107.46 115.99 49.99 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 C-N-CA 124.866 1.266 . . . . 0.0 108.626 171.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 23.6 p -87.92 161.72 17.3 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.858 1.263 . . . . 0.0 110.925 -179.506 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -58.13 153.01 15.65 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 122.879 0.471 . . . . 0.0 110.376 168.295 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 17.2 mtt180 . . . . . 0 N--CA 1.467 0.386 0 C-N-CA 123.448 0.699 . . . . 0.0 110.011 176.688 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 15.2 t . . . . . 0 N--CA 1.47 0.555 0 N-CA-C 110.197 -0.298 . . . . 0.0 110.197 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -148.38 121.78 9.06 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.019 1.328 . . . . 0.0 111.075 -169.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 89.8 p -140.94 160.23 59.1 Favored Pre-proline 0 CA--C 1.55 0.981 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -172.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -68.49 162.55 79.94 Favored 'Cis proline' 0 C--N 1.354 0.825 0 CA-C-N 119.883 0.994 . . . . 0.0 111.482 -7.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.6 -30.74 71.57 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 174.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 33.1 tp -135.46 123.37 22.63 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.739 1.615 . . . . 0.0 109.061 171.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 57.6 tp -107.49 126.6 52.72 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.587 1.155 . . . . 0.0 109.358 169.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.4 t -110.2 124.32 66.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 124.011 0.924 . . . . 0.0 108.916 173.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.6 m -128.24 167.29 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 124.904 1.282 . . . . 0.0 111.938 173.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 51.4 m -93.62 148.92 21.66 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.571 1.148 . . . . 0.0 110.466 175.274 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -53.97 119.33 4.89 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.414 1.486 . . . . 0.0 112.103 178.227 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.04 -0.43 78.9 Favored Glycine 0 CA--C 1.532 1.124 0 C-N-CA 126.21 1.862 . . . . 0.0 115.057 -178.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 40.6 t0 -86.15 158.73 19.7 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 119.11 1.455 . . . . 0.0 111.223 171.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 12.1 p30 -80.85 150.84 28.96 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-O 121.911 0.862 . . . . 0.0 111.453 169.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -133.38 122.59 23.99 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.125 1.77 . . . . 0.0 110.576 -173.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 28.0 m -129.38 126.86 39.82 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 118.832 0.742 . . . . 0.0 111.854 -176.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -101.95 157.07 17.13 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.212 1.805 . . . . 0.0 109.817 169.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 31.6 m -106.35 123.78 48.58 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.944 1.298 . . . . 0.0 109.553 175.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 44.8 t -107.08 134.76 49.73 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.657 1.183 . . . . 0.0 109.735 168.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 9.2 m -133.72 128.82 35.72 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.7 0.8 . . . . 0.0 110.222 -174.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.1 p90 . . . . . 0 CA--C 1.537 0.476 0 C-N-CA 124.373 1.069 . . . . 0.0 111.595 173.767 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 32.9 p90 . . . . . 0 CA--C 1.538 0.507 0 N-CA-C 115.154 1.538 . . . . 0.0 115.154 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 58.2 t -124.33 135.29 64.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 127.49 2.316 . . . . 0.0 106.981 167.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 29.3 tp -99.39 138.7 36.11 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.509 0.724 . . . . 0.0 109.924 172.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 7.2 m-80 -130.93 159.19 38.17 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.818 1.247 . . . . 0.0 111.483 -172.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 9.0 t90 -125.84 138.21 53.8 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.312 1.045 . . . . 0.0 111.979 177.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -131.15 144.7 51.57 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.777 1.231 . . . . 0.0 112.796 -176.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -106.78 142.61 36.14 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.45 1.5 . . . . 0.0 108.54 168.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 26.1 mtp -83.29 143.91 30.07 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.95 0.795 . . . . 0.0 112.461 175.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 69.0 m -105.69 148.55 36.63 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 125.47 1.508 . . . . 0.0 111.081 176.028 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -68.05 -16.04 44.24 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 123.977 3.118 . . . . 0.0 114.024 -173.236 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 17.5 m -76.91 8.61 3.59 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.812 1.245 . . . . 0.0 113.206 171.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 57.6 t30 71.31 46.07 0.45 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 127.805 2.442 . . . . 0.0 111.466 -177.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -131.38 -172.66 2.9 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.669 1.588 . . . . 0.0 110.27 -178.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.7 p -144.47 149.18 35.56 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.964 1.706 . . . . 0.0 110.526 -176.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -125.28 134.65 52.2 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.106 1.362 . . . . 0.0 111.314 176.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -78.84 133.0 37.04 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.988 0.915 . . . . 0.0 111.517 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 53.5 mt -107.65 -46.77 3.75 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.767 1.227 . . . . 0.0 112.714 -169.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -169.79 169.42 8.42 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.73 2.012 . . . . 0.0 110.482 -172.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -157.25 162.01 39.22 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.861 1.265 . . . . 0.0 113.163 -179.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -139.92 122.5 10.12 Favored Pre-proline 0 CA--C 1.547 0.839 0 C-N-CA 126.326 1.851 . . . . 0.0 110.1 174.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_exo . . . . . 0 C--N 1.351 0.661 0 CA-C-N 120.56 1.236 . . . . 0.0 113.719 -7.659 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 41.3 mtm180 . . . . . 0 CA--C 1.533 0.301 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -67.22 142.11 57.06 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.548 1.539 . . . . 0.0 110.968 168.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 85.0 mtm180 -143.85 148.75 35.94 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.997 1.719 . . . . 0.0 111.281 -174.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 40.2 t -126.49 126.33 68.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 125.451 1.5 . . . . 0.0 108.452 171.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 87.9 m -130.61 130.52 44.1 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.075 0.95 . . . . 0.0 110.996 178.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 65.4 tt0 -82.85 135.08 35.05 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 118.658 0.663 . . . . 0.0 110.042 169.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 37.1 mt -91.85 158.94 39.13 Favored Pre-proline 0 CA--C 1.543 0.681 0 C-N-CA 124.112 0.965 . . . . 0.0 112.205 -172.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -63.92 -6.88 11.9 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 123.64 2.893 . . . . 0.0 114.02 174.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -63.32 -26.15 68.63 Favored 'General case' 0 CA--C 1.55 0.974 0 CA-C-N 119.462 1.028 . . . . 0.0 112.155 168.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 91.19 -34.08 4.44 Favored Glycine 0 CA--C 1.531 1.037 0 C-N-CA 126.717 2.103 . . . . 0.0 113.938 175.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -126.84 73.44 1.41 Allowed 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.917 1.287 . . . . 0.0 109.48 171.376 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -178.37 146.0 0.36 Allowed 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 126.396 1.878 . . . . 0.0 110.742 -177.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -145.83 139.8 26.62 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.031 0.933 . . . . 0.0 111.773 -170.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -98.91 131.03 45.3 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.403 1.081 . . . . 0.0 111.85 169.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 20.8 mmt -108.98 103.24 12.23 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.983 2.113 . . . . 0.0 107.726 174.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 22.8 t -121.46 125.55 47.16 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 114.9 1.444 . . . . 0.0 114.9 -167.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 3.7 t -92.35 123.24 44.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 125.244 1.417 . . . . 0.0 108.229 168.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 87.6 t -82.89 128.4 38.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 168.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 44.3 ttt85 56.78 69.67 0.72 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.787 1.235 . . . . 0.0 112.07 171.03 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -74.35 134.48 42.5 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.409 1.083 . . . . 0.0 111.508 -177.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -108.63 163.03 13.6 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.032 1.733 . . . . 0.0 109.666 174.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 64.6 mtp85 -56.83 -28.01 60.94 Favored 'General case' 0 N--CA 1.478 0.947 0 O-C-N 121.021 -1.049 . . . . 0.0 113.74 179.116 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -61.46 -16.72 49.79 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.306 1.443 . . . . 0.0 114.623 171.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -89.68 -12.84 38.35 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.218 1.407 . . . . 0.0 113.634 178.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 48.1 m -64.74 138.16 58.22 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 120.815 -1.178 . . . . 0.0 112.132 -178.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 149.2 -165.8 29.43 Favored Glycine 0 N--CA 1.474 1.192 0 C-N-CA 124.13 0.871 . . . . 0.0 113.592 -176.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.5 m -91.23 142.66 27.48 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.165 1.386 . . . . 0.0 111.284 -174.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -138.78 160.82 38.76 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.678 1.991 . . . . 0.0 111.745 -178.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -156.29 147.12 21.96 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.603 1.161 . . . . 0.0 113.355 173.517 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 51.4 t -84.16 150.44 25.51 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.341 1.857 . . . . 0.0 110.704 173.156 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -161.43 129.52 2.13 Favored Glycine 0 N--CA 1.474 1.172 0 O-C-N 121.184 -0.947 . . . . 0.0 114.4 174.209 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -90.66 159.26 16.49 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.151 0.981 . . . . 0.0 112.197 178.638 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 17.2 tt -146.39 138.67 19.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 124.702 1.201 . . . . 0.0 109.781 170.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 7.3 m -81.11 161.48 24.1 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.763 0.825 . . . . 0.0 112.384 179.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 55.9 mt -78.6 -12.51 60.02 Favored 'General case' 0 N--CA 1.476 0.875 0 N-CA-C 114.115 1.154 . . . . 0.0 114.115 178.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -67.03 148.19 98.93 Favored Pre-proline 0 CA--C 1.553 1.064 0 C-N-CA 124.12 0.968 . . . . 0.0 112.532 179.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -55.96 -28.79 70.46 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 123.598 2.865 . . . . 0.0 114.601 176.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -85.14 4.42 34.45 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.747 1.219 . . . . 0.0 114.227 -179.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -63.09 159.17 17.88 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.99 1.108 . . . . 0.0 113.99 -176.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -150.63 166.54 30.02 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.73 2.012 . . . . 0.0 109.005 174.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 51.0 mt -73.11 114.16 12.05 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-O 121.584 0.707 . . . . 0.0 109.918 -178.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -81.47 88.37 6.16 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.991 1.716 . . . . 0.0 107.917 169.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -75.4 141.73 43.18 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.136 0.975 . . . . 0.0 112.354 -171.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 6.9 t -91.35 178.64 5.91 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.803 1.241 . . . . 0.0 111.848 169.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.6 pp -76.35 159.05 30.88 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.868 0.867 . . . . 0.0 112.061 174.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 91.0 mtm180 -83.58 150.54 25.87 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.251 1.02 . . . . 0.0 113.038 -174.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -136.93 169.62 17.47 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 127.164 2.186 . . . . 0.0 109.693 169.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -132.57 147.57 52.35 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 177.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 63.6 tp -107.41 134.46 50.42 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 126.982 2.113 . . . . 0.0 109.954 177.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 69.5 ttt180 -122.62 121.55 36.7 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 125.938 1.695 . . . . 0.0 109.885 171.393 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 44.2 t -103.39 117.6 49.09 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.704 1.202 . . . . 0.0 108.848 170.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 74.4 p -96.54 150.97 20.03 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.578 1.551 . . . . 0.0 110.24 177.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -64.03 142.74 58.3 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.328 0.585 . . . . 0.0 111.851 -178.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 54.1 ttp180 . . . . . 0 CA--C 1.535 0.372 0 C-N-CA 123.782 0.833 . . . . 0.0 110.147 179.291 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 66.6 p . . . . . 0 N--CA 1.471 0.615 0 CA-C-O 121.891 0.853 . . . . 0.0 112.043 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -144.14 124.66 13.98 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.043 1.737 . . . . 0.0 108.869 178.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 78.9 p -140.82 161.15 55.67 Favored Pre-proline 0 CA--C 1.55 0.95 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 -168.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -66.43 163.54 69.51 Favored 'Cis proline' 0 C--N 1.355 0.881 0 CA-C-N 119.572 0.883 . . . . 0.0 111.664 -7.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.78 -33.12 71.28 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 174.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.6 tt -136.34 124.32 22.82 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.61 1.564 . . . . 0.0 109.139 171.02 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.4 tp -106.75 130.3 54.49 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.75 1.22 . . . . 0.0 108.948 169.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 12.8 p -113.0 129.92 67.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 C-N-CA 124.007 0.923 . . . . 0.0 109.692 169.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.6 m -131.81 164.76 33.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 125.065 1.346 . . . . 0.0 111.348 174.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 16.8 m -89.87 149.02 22.83 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.553 1.141 . . . . 0.0 110.303 172.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -53.88 121.7 8.5 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.047 1.339 . . . . 0.0 111.015 175.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.24 4.12 78.01 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 125.486 1.517 . . . . 0.0 114.894 -176.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -95.71 150.21 20.63 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 119.577 1.688 . . . . 0.0 111.159 169.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -75.41 130.77 39.5 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.267 -0.896 . . . . 0.0 111.543 175.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -101.71 122.08 43.25 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 125.47 1.508 . . . . 0.0 110.174 175.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 60.5 m -128.16 124.35 36.62 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.023 0.929 . . . . 0.0 110.827 -178.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -102.45 159.54 15.34 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 127.21 2.204 . . . . 0.0 110.524 175.265 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 30.7 m -113.21 127.55 56.21 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.956 1.302 . . . . 0.0 110.006 177.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 53.1 t -111.66 142.02 44.51 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.785 1.634 . . . . 0.0 111.854 173.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.5 t -138.89 119.32 13.8 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.717 0.807 . . . . 0.0 111.309 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 . . . . . 0 N--CA 1.472 0.646 0 C-N-CA 126.235 1.814 . . . . 0.0 113.103 -179.939 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 55.2 p90 . . . . . 0 CA--C 1.54 0.565 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 90.7 t -95.97 134.77 32.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 125.672 1.589 . . . . 0.0 107.467 169.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.4 tp -99.33 145.84 26.9 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.705 1.202 . . . . 0.0 109.472 170.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -134.92 156.76 48.41 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.844 1.657 . . . . 0.0 111.984 -169.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 22.6 t90 -136.24 138.84 42.24 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.553 1.141 . . . . 0.0 112.103 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 48.6 m-85 -138.9 149.09 44.43 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.818 1.247 . . . . 0.0 114.009 -172.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -109.13 143.36 38.61 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.779 1.631 . . . . 0.0 108.531 167.566 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 31.7 mtp -84.58 143.92 28.98 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 119.437 1.017 . . . . 0.0 112.612 173.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 45.6 m -91.48 158.02 41.31 Favored Pre-proline 0 CA--C 1.548 0.901 0 C-N-CA 124.954 1.302 . . . . 0.0 111.601 173.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_exo -55.5 -32.39 82.3 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 123.983 3.122 . . . . 0.0 114.495 178.373 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.0 m -76.94 5.93 7.11 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 124.892 1.277 . . . . 0.0 113.845 177.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 73.99 20.94 2.71 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 127.828 2.451 . . . . 0.0 113.041 -176.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -89.4 -172.61 3.68 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.585 1.154 . . . . 0.0 110.287 169.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.1 p -144.06 146.96 33.18 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 125.597 1.559 . . . . 0.0 110.521 -176.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -121.96 132.42 54.53 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 125.077 1.351 . . . . 0.0 110.848 175.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 33.3 tttm -80.57 117.18 21.05 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.194 1.398 . . . . 0.0 110.9 -177.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 71.7 mt -90.07 -52.72 4.81 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 125.187 1.395 . . . . 0.0 111.253 -172.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -160.74 173.51 15.3 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.84 1.256 . . . . 0.0 111.79 -178.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -156.06 156.4 34.31 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.437 1.495 . . . . 0.0 111.798 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -142.0 129.46 11.5 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 125.004 1.322 . . . . 0.0 110.73 178.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo . . . . . 0 C--N 1.353 0.766 0 CA-C-N 120.498 1.214 . . . . 0.0 112.825 -8.315 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 48.1 mtp180 . . . . . 0 N--CA 1.467 0.422 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -97.7 119.71 36.77 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.221 1.409 . . . . 0.0 110.398 -174.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -139.48 145.67 39.06 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.416 1.086 . . . . 0.0 112.044 -169.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -126.56 135.95 62.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 125.153 1.381 . . . . 0.0 112.052 170.616 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 91.8 m -130.5 130.17 43.84 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.446 1.498 . . . . 0.0 110.756 -177.081 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -79.37 134.32 36.58 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.318 1.047 . . . . 0.0 110.371 173.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 36.4 mt -88.27 159.65 47.18 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 123.657 0.783 . . . . 0.0 111.829 178.199 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -63.4 -7.46 12.38 Favored 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 123.563 2.842 . . . . 0.0 113.979 173.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -67.23 -14.5 62.97 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 119.174 0.897 . . . . 0.0 112.946 169.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 83.98 -34.08 3.04 Favored Glycine 0 N--CA 1.473 1.123 0 C-N-CA 126.92 2.2 . . . . 0.0 114.343 172.092 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.67 73.59 1.46 Allowed 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 123.733 1.73 . . . . 0.0 109.669 173.349 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -174.89 141.72 0.62 Allowed 'General case' 0 C--O 1.237 0.418 0 C-N-CA 128.51 2.724 . . . . 0.0 108.095 -176.413 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -145.04 149.92 35.96 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.853 1.057 . . . . 0.0 113.853 -167.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -104.06 132.77 49.97 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.805 1.242 . . . . 0.0 110.479 167.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -112.87 123.31 50.02 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 126.652 1.981 . . . . 0.0 108.211 174.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 9.4 t -130.44 133.75 46.58 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 114.257 1.206 . . . . 0.0 114.257 -169.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 61.7 t -105.35 101.92 13.07 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 126.651 1.98 . . . . 0.0 106.817 168.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 98.0 t -73.2 125.53 32.3 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 123.66 0.784 . . . . 0.0 110.649 -177.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 72.3 mtt-85 51.08 70.42 0.53 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.597 1.959 . . . . 0.0 112.034 -177.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -66.34 134.09 51.86 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.79 1.636 . . . . 0.0 111.476 -178.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 8.3 mpt_? -108.38 166.68 10.58 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 126.11 1.764 . . . . 0.0 109.289 172.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 35.2 mtp180 -57.22 -30.2 64.39 Favored 'General case' 0 N--CA 1.478 0.962 0 O-C-N 121.033 -1.042 . . . . 0.0 113.619 -174.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -61.68 -19.39 62.29 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.464 1.506 . . . . 0.0 114.756 173.222 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 37.4 m-20 -84.59 -12.83 53.28 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 119.966 1.257 . . . . 0.0 113.481 177.223 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 48.4 m -63.1 143.85 57.42 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.734 1.152 . . . . 0.0 112.597 -179.466 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 143.42 -166.83 26.72 Favored Glycine 0 N--CA 1.474 1.173 0 O-C-N 121.262 -0.898 . . . . 0.0 113.469 -176.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.9 m -91.71 143.59 26.39 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 125.173 1.389 . . . . 0.0 111.08 -172.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -142.19 161.2 38.6 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.09 1.756 . . . . 0.0 111.57 -177.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -161.68 165.12 28.66 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.926 1.29 . . . . 0.0 113.054 177.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 13.6 t -108.79 156.65 19.38 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.974 1.709 . . . . 0.0 111.038 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -144.66 174.6 24.76 Favored Glycine 0 N--CA 1.47 0.959 0 C-N-CA 124.791 1.186 . . . . 0.0 113.436 176.274 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -152.45 159.24 43.39 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.184 0.994 . . . . 0.0 112.934 175.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 18.1 tt -152.22 135.01 6.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 125.463 1.505 . . . . 0.0 110.286 174.511 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 58.1 p -72.48 161.51 30.7 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.249 -0.907 . . . . 0.0 113.146 178.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 48.2 mt -75.58 -2.15 27.81 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 -179.029 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -68.07 150.83 97.6 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 124.611 1.164 . . . . 0.0 112.521 177.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_endo -69.51 -23.59 31.75 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.016 2.477 . . . . 0.0 112.787 176.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -91.38 8.1 37.83 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 125.088 1.355 . . . . 0.0 113.717 178.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.14 161.71 18.52 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.743 1.217 . . . . 0.0 113.922 -175.124 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -149.48 151.83 34.6 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.783 1.633 . . . . 0.0 109.251 178.233 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 51.2 mt -76.1 127.78 37.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 123.594 0.758 . . . . 0.0 111.957 -173.174 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -99.35 151.03 21.53 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.126 1.77 . . . . 0.0 109.328 168.097 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -132.54 149.12 52.37 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.27 1.028 . . . . 0.0 111.969 -172.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 60.6 p -87.6 177.85 6.94 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.858 1.263 . . . . 0.0 113.725 175.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -68.38 152.25 45.7 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.636 0.774 . . . . 0.0 109.208 166.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -82.12 152.84 26.36 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.113 0.965 . . . . 0.0 113.332 -177.405 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -124.67 169.66 11.75 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 127.158 2.183 . . . . 0.0 109.932 169.038 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -135.97 151.51 50.01 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 170.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 60.4 tp -112.87 132.91 55.1 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 126.704 2.002 . . . . 0.0 110.543 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 69.9 ttt180 -118.06 118.06 30.89 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.477 1.911 . . . . 0.0 109.663 171.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 42.4 t -102.3 116.67 46.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 123.82 0.848 . . . . 0.0 109.012 169.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 73.7 p -95.96 154.2 17.36 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.967 1.707 . . . . 0.0 110.606 178.251 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -64.61 145.61 55.91 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.641 -0.662 . . . . 0.0 112.32 -178.06 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 38.9 ttt85 . . . . . 0 N--CA 1.469 0.489 0 C-N-CA 124.476 1.111 . . . . 0.0 110.361 179.909 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.8 t . . . . . 0 N--CA 1.475 0.812 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.535 ' CE1' ' HB3' ' A' ' 123' ' ' CYS . 1.0 OUTLIER -125.99 136.52 53.08 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 125.522 1.529 . . . . 0.0 109.674 178.164 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 88.9 p -141.02 156.2 68.44 Favored Pre-proline 0 N--CA 1.478 0.935 0 N-CA-C 114.793 1.405 . . . . 0.0 114.793 -178.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -69.52 161.55 85.24 Favored 'Cis proline' 0 C--N 1.352 0.747 0 CA-C-N 119.307 0.788 . . . . 0.0 111.194 -10.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.47 -34.09 73.52 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 172.418 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 31.9 tp -132.83 121.14 22.51 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.757 1.623 . . . . 0.0 109.04 171.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 51.5 tp -105.09 130.38 53.29 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.63 1.172 . . . . 0.0 109.475 170.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.1 t -112.92 124.97 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 123.864 0.865 . . . . 0.0 109.104 173.087 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.3 m -127.22 166.36 24.1 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 C-N-CA 125.03 1.332 . . . . 0.0 111.828 173.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 45.4 m -91.47 147.16 23.22 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.337 1.055 . . . . 0.0 110.211 173.384 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 65.1 tt0 -53.96 116.44 2.56 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.79 1.636 . . . . 0.0 112.245 177.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 94.23 3.61 63.28 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 126.365 1.936 . . . . 0.0 114.825 -177.25 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 37.2 t0 -91.2 159.51 16.02 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 119.581 1.69 . . . . 0.0 111.622 172.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -85.32 130.58 34.56 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.224 -0.923 . . . . 0.0 111.373 172.263 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -103.01 133.83 47.47 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.923 1.689 . . . . 0.0 110.745 178.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 27.8 m -132.74 127.98 35.88 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.446 1.099 . . . . 0.0 111.906 178.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -105.36 159.56 15.81 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.222 2.209 . . . . 0.0 110.465 169.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 29.7 m -101.13 140.58 35.23 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.606 1.563 . . . . 0.0 109.182 169.56 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 17.4 t -131.53 131.94 43.78 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.697 1.599 . . . . 0.0 111.594 171.586 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 9.9 m -122.97 132.71 54.27 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.38 1.072 . . . . 0.0 111.109 179.271 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 . . . . . 0 N--CA 1.47 0.552 0 C-N-CA 126.168 1.787 . . . . 0.0 113.157 169.455 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 38.1 p90 . . . . . 0 CA--C 1.541 0.621 0 CA-C-O 120.905 0.383 . . . . 0.0 111.809 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 30.4 t -95.97 138.27 21.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 125.387 1.475 . . . . 0.0 107.594 170.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 9.0 tt -127.78 131.26 49.64 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.373 1.469 . . . . 0.0 109.583 -177.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -145.66 160.91 41.0 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 115.323 1.601 . . . . 0.0 115.323 -167.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 61.1 t-105 -113.94 148.84 36.16 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 126.585 1.954 . . . . 0.0 112.253 -179.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -141.14 146.63 37.27 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.528 1.531 . . . . 0.0 113.89 -172.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 34.3 ttp-105 -91.21 140.21 30.01 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.887 1.675 . . . . 0.0 108.152 167.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 21.1 mtp -86.6 136.75 32.93 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 119.328 0.967 . . . . 0.0 111.021 168.274 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 68.8 m -106.32 148.67 37.11 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 125.143 1.377 . . . . 0.0 110.986 177.187 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -68.45 -17.6 43.81 Favored 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 124.085 3.19 . . . . 0.0 113.711 -171.065 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.4 m -76.97 21.31 0.22 Allowed 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 125.278 1.431 . . . . 0.0 112.927 170.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 64.5 t30 64.35 39.99 6.79 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.685 2.394 . . . . 0.0 112.455 177.447 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -133.05 179.24 6.3 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.139 1.376 . . . . 0.0 111.001 -172.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.8 p -137.03 152.51 50.19 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 125.528 1.531 . . . . 0.0 111.043 -177.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -133.33 131.56 40.27 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.747 1.219 . . . . 0.0 110.88 178.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 5.4 ttpm? -78.91 132.43 36.75 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.553 0.741 . . . . 0.0 111.876 -173.355 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 83.9 mt -110.49 -46.82 3.35 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 125.038 1.335 . . . . 0.0 112.205 -171.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -152.84 160.02 43.07 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.39 1.076 . . . . 0.0 111.573 -179.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -154.07 149.05 26.74 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.513 1.125 . . . . 0.0 112.977 -172.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -136.02 126.8 16.79 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 125.916 1.686 . . . . 0.0 109.908 169.456 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo . . . . . 0 C--N 1.351 0.709 0 CA-C-N 120.275 1.134 . . . . 0.0 113.278 -10.733 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 47.8 mtp180 . . . . . 0 N--CA 1.469 0.507 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -95.98 133.63 39.97 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.222 1.009 . . . . 0.0 111.083 -176.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 66.2 mtm180 -143.33 152.24 41.41 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.174 0.99 . . . . 0.0 113.105 -171.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.8 t -121.61 130.61 74.45 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 126.483 1.913 . . . . 0.0 108.562 169.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 94.6 m -129.44 135.41 48.63 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 125.17 1.388 . . . . 0.0 110.444 -175.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -76.31 141.75 41.5 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.217 1.007 . . . . 0.0 111.519 178.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 96.4 mt -101.48 157.05 34.4 Favored Pre-proline 0 CA--C 1.542 0.661 0 C-N-CA 124.16 0.984 . . . . 0.0 111.582 170.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -70.39 -2.8 11.21 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 123.537 2.825 . . . . 0.0 113.527 173.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -72.46 -6.0 40.63 Favored 'General case' 0 CA--C 1.551 1.019 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -179.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 95.55 -31.92 6.72 Favored Glycine 0 CA--C 1.534 1.266 0 C-N-CA 126.019 1.771 . . . . 0.0 115.27 169.47 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 32.6 ptt180 -154.6 73.76 0.91 Allowed 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.546 1.538 . . . . 0.0 109.905 172.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -167.36 145.47 4.77 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 126.287 1.835 . . . . 0.0 108.925 -169.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -144.42 150.11 37.15 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -168.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -101.1 138.0 38.71 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.239 1.416 . . . . 0.0 110.111 167.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 6.9 mmt -123.51 117.84 26.02 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 126.545 1.938 . . . . 0.0 108.3 -176.002 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 71.0 p -131.27 148.7 52.72 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 115.602 1.704 . . . . 0.0 115.602 -169.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 22.1 t -118.66 102.76 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 C-N-CA 127.478 2.311 . . . . 0.0 107.233 176.55 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 58.6 t -78.02 131.86 33.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 124.006 0.923 . . . . 0.0 110.147 -178.015 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 3.7 tpt180 63.07 53.93 2.22 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.423 1.489 . . . . 0.0 111.198 175.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.43 123.61 22.75 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.573 1.149 . . . . 0.0 111.062 -174.392 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? -106.73 169.76 8.34 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 126.085 1.754 . . . . 0.0 110.295 177.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 22.2 mmm180 -49.19 -37.35 22.33 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.61 1.164 . . . . 0.0 113.84 -175.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -60.07 -25.09 65.1 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 125.271 1.429 . . . . 0.0 114.697 175.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 -81.8 -1.87 48.88 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.896 1.278 . . . . 0.0 113.272 178.44 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 33.1 m -70.32 124.04 23.18 Favored 'General case' 0 CA--C 1.543 0.699 0 O-C-N 120.18 -1.575 . . . . 0.0 111.238 173.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 165.96 -171.48 41.08 Favored Glycine 0 N--CA 1.474 1.173 0 O-C-N 121.682 -0.636 . . . . 0.0 114.306 -177.068 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.0 m -88.9 139.72 30.17 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.725 1.21 . . . . 0.0 110.714 -179.254 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -144.2 157.67 44.16 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.046 1.738 . . . . 0.0 111.007 -177.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.5 pp -155.16 165.36 36.93 Favored 'General case' 0 N--CA 1.469 0.478 0 O-C-N 121.25 -0.906 . . . . 0.0 113.243 -178.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . 0.535 ' HB3' ' CE1' ' A' ' 37' ' ' PHE . 48.4 t -111.16 156.12 21.88 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.243 1.417 . . . . 0.0 110.574 175.064 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -144.51 167.95 26.89 Favored Glycine 0 CA--C 1.524 0.653 0 C-N-CA 124.496 1.046 . . . . 0.0 112.536 171.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -145.13 149.34 34.83 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.869 0.868 . . . . 0.0 111.844 175.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.4 tt -148.9 133.08 8.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 125.452 1.501 . . . . 0.0 110.842 -176.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 14.5 m -66.39 159.58 26.61 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.397 1.079 . . . . 0.0 112.656 179.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 29.4 mt -73.28 -14.38 61.3 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.213 1.19 . . . . 0.0 114.213 -174.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -72.35 143.03 85.09 Favored Pre-proline 0 CA--C 1.552 1.054 0 C-N-CA 124.294 1.037 . . . . 0.0 112.329 177.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -56.22 -27.01 64.07 Favored 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 123.829 3.019 . . . . 0.0 115.153 177.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -78.81 -4.34 48.96 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 -178.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.97 169.49 13.18 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 124.891 1.276 . . . . 0.0 113.766 -176.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -149.76 162.48 40.18 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.157 1.783 . . . . 0.0 110.21 175.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 10.0 mm -73.08 123.44 27.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-O 121.756 0.789 . . . . 0.0 111.757 -178.217 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -84.67 143.29 29.31 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 126.799 2.04 . . . . 0.0 110.171 169.636 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -134.14 158.85 42.6 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.594 1.558 . . . . 0.0 112.188 -172.12 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 5.9 t -140.21 -163.88 1.6 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.784 1.234 . . . . 0.0 111.664 169.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -65.89 114.34 5.04 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.545 1.538 . . . . 0.0 110.424 -178.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 1.4 ptp180 -71.43 154.74 41.31 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 125.372 1.469 . . . . 0.0 112.939 -177.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.89 169.63 9.09 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.633 1.973 . . . . 0.0 111.225 -171.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -136.51 146.84 46.69 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 122.228 1.013 . . . . 0.0 112.956 175.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 58.4 tp -109.69 134.29 52.14 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 127.1 2.16 . . . . 0.0 109.531 179.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 70.6 ttt180 -121.12 123.91 43.46 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 125.937 1.695 . . . . 0.0 109.574 171.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 53.9 t -103.07 120.44 52.93 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 C-N-CA 124.497 1.119 . . . . 0.0 108.132 169.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 54.7 p -93.29 147.53 22.83 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.289 1.436 . . . . 0.0 109.411 174.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -59.86 148.07 36.1 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.444 0.698 . . . . 0.0 112.244 -174.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 60.1 ttp180 . . . . . 0 C--O 1.238 0.45 0 C-N-CA 125.016 1.326 . . . . 0.0 110.199 -170.947 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.2 t . . . . . 0 N--CA 1.476 0.858 0 CA-C-O 120.52 0.2 . . . . 0.0 111.395 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -122.52 135.36 54.63 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.166 1.386 . . . . 0.0 110.776 -172.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 94.2 p -141.01 157.14 67.84 Favored Pre-proline 0 CA--C 1.55 0.98 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -179.007 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -69.84 162.58 84.05 Favored 'Cis proline' 0 C--N 1.353 0.809 0 CA-C-N 118.919 0.65 . . . . 0.0 111.279 -9.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.33 -34.1 71.94 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 171.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 53.2 tp -140.16 122.91 16.4 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.433 1.493 . . . . 0.0 109.41 172.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.9 tp -105.16 127.23 52.81 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.76 1.624 . . . . 0.0 109.186 171.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.8 t -111.05 124.5 67.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 123.912 0.885 . . . . 0.0 108.879 172.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.1 m -129.38 168.14 23.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 C-N-CA 124.935 1.294 . . . . 0.0 111.567 172.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 23.4 m -92.33 151.67 20.17 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.165 1.386 . . . . 0.0 110.44 173.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -52.13 123.89 11.68 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.436 1.094 . . . . 0.0 110.7 169.026 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 89.5 -2.92 83.43 Favored Glycine 0 CA--C 1.533 1.16 0 C-N-CA 125.616 1.579 . . . . 0.0 114.762 -177.614 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -91.31 158.39 16.58 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 119.393 1.597 . . . . 0.0 112.012 175.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -87.65 123.59 32.65 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.171 0.988 . . . . 0.0 110.901 178.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -101.59 129.96 47.81 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.955 1.302 . . . . 0.0 110.534 177.072 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 27.1 m -131.7 128.02 38.09 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.407 1.083 . . . . 0.0 111.021 177.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -102.8 154.5 19.12 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 126.628 1.971 . . . . 0.0 110.505 169.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 65.4 m -107.37 134.15 50.85 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.172 1.389 . . . . 0.0 109.001 170.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 73.2 m -130.05 114.73 16.14 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.653 1.181 . . . . 0.0 110.337 175.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 22.6 t -97.4 154.65 17.33 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 125.142 1.377 . . . . 0.0 110.237 179.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 53.8 m-85 . . . . . 0 CA--C 1.536 0.412 0 C-N-CA 124.742 1.217 . . . . 0.0 113.979 -169.944 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 38.5 p90 . . . . . 0 CA--C 1.539 0.535 0 CA-C-O 121.128 0.49 . . . . 0.0 112.031 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.7 t -95.95 133.08 38.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 125.513 1.525 . . . . 0.0 108.178 169.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.32 129.46 45.53 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.445 1.098 . . . . 0.0 108.694 169.264 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 35.2 m120 -125.52 147.75 49.14 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.108 1.363 . . . . 0.0 111.133 179.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 18.9 t90 -122.02 139.39 53.75 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.482 1.113 . . . . 0.0 111.473 176.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -135.44 144.84 46.68 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.496 1.118 . . . . 0.0 113.859 -170.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.4 ttt-85 -106.54 134.97 48.86 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.516 1.126 . . . . 0.0 108.85 167.556 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.95 130.36 34.49 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.679 1.592 . . . . 0.0 110.614 170.643 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 19.0 m -104.31 158.79 31.2 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 126.014 1.725 . . . . 0.0 111.727 179.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -67.71 -17.42 47.65 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 123.986 3.124 . . . . 0.0 113.98 -174.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 70.6 m -80.08 21.94 0.55 Allowed 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 124.33 1.052 . . . . 0.0 112.28 168.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . 0.274 0.9 OUTLIER 54.31 33.85 19.28 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 128.147 2.579 . . . . 0.0 114.561 179.265 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -118.01 158.9 24.12 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.793 1.237 . . . . 0.0 111.397 178.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.3 p -113.0 144.35 42.74 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 125.815 1.646 . . . . 0.0 109.79 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -129.04 130.69 46.91 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 123.636 0.774 . . . . 0.0 111.313 177.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 32.0 ttmt -74.24 121.15 20.82 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.688 1.195 . . . . 0.0 110.355 -178.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 80.2 mt -94.48 -47.57 6.5 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 125.51 1.524 . . . . 0.0 111.911 -170.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -167.84 170.5 10.67 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 127.287 2.235 . . . . 0.0 109.18 -177.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.65 161.78 35.04 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.181 0.992 . . . . 0.0 112.451 -171.124 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -144.18 118.5 5.92 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.872 1.269 . . . . 0.0 111.131 169.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo . . . . . 0 C--N 1.352 0.715 0 CA-C-N 120.027 1.045 . . . . 0.0 112.166 -11.571 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 12.2 ptp180 . . . . . 0 N--CA 1.472 0.671 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -93.77 137.42 33.03 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.49 1.116 . . . . 0.0 112.171 -173.173 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 72.1 mtm180 -140.72 151.51 44.56 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.804 1.241 . . . . 0.0 112.607 -179.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 59.0 t -126.51 126.65 69.37 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 126.078 1.751 . . . . 0.0 109.002 169.035 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 99.5 m -118.53 132.55 56.21 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.736 1.614 . . . . 0.0 109.78 176.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.17 141.74 28.32 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.617 1.167 . . . . 0.0 111.949 176.572 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 32.1 mt -97.77 157.98 33.74 Favored Pre-proline 0 CA--C 1.544 0.723 0 C-N-CA 123.749 0.82 . . . . 0.0 111.149 175.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -65.66 -5.02 10.81 Favored 'Trans proline' 0 CA--C 1.541 0.858 0 C-N-CA 123.411 2.741 . . . . 0.0 114.369 177.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -66.53 -25.99 66.93 Favored 'General case' 0 CA--C 1.55 0.947 0 CA-C-N 119.793 1.178 . . . . 0.0 112.428 169.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 86.68 -27.27 5.94 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 125.619 1.58 . . . . 0.0 114.04 178.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -130.91 73.34 1.54 Allowed 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 122.849 1.309 . . . . 0.0 108.664 171.509 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 13.2 t0 178.99 136.57 0.09 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.907 2.083 . . . . 0.0 108.596 -173.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -148.59 152.23 36.4 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.86 0.864 . . . . 0.0 112.773 -168.062 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 -113.62 127.06 55.92 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.169 1.388 . . . . 0.0 109.63 168.387 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 2.4 mpt? -119.1 136.51 54.12 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.622 1.169 . . . . 0.0 109.684 -179.191 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 50.4 p -141.98 147.3 36.74 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 116.122 1.897 . . . . 0.0 116.122 -169.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 21.9 t -103.52 109.09 26.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 126.642 1.977 . . . . 0.0 107.302 170.021 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 91.9 t -76.11 127.55 37.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 124.493 1.117 . . . . 0.0 109.423 175.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 53.6 ttt85 53.88 59.5 4.24 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.147 1.379 . . . . 0.0 110.955 176.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.47 150.7 47.91 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.836 0.854 . . . . 0.0 112.434 -171.537 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.95 162.63 31.53 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.934 1.693 . . . . 0.0 110.686 -179.406 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 76.9 mtm180 -55.88 -22.37 25.11 Favored 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 114.474 1.287 . . . . 0.0 114.474 -177.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -55.28 -37.96 67.98 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.846 1.258 . . . . 0.0 112.835 168.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -80.97 -26.16 36.8 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.215 1.006 . . . . 0.0 113.096 -169.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 46.4 m -49.74 138.41 14.56 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.935 1.294 . . . . 0.0 112.963 178.177 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 155.7 -164.26 32.08 Favored Glycine 0 N--CA 1.472 1.037 0 C-N-CA 123.88 0.753 . . . . 0.0 113.198 -176.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 21.9 m -89.95 144.61 25.77 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.276 1.031 . . . . 0.0 109.293 175.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 34.2 m-85 -135.65 158.36 44.57 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.6 1.56 . . . . 0.0 112.174 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -160.87 151.9 18.74 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 124.953 1.301 . . . . 0.0 112.3 175.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 85.3 m -103.39 170.76 7.76 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.787 1.235 . . . . 0.0 110.969 173.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -164.82 140.24 6.3 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 121.258 -0.901 . . . . 0.0 114.078 172.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -104.34 142.98 33.61 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.562 1.145 . . . . 0.0 111.124 173.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.0 tt -145.47 134.42 17.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 124.209 1.003 . . . . 0.0 111.057 176.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 2.2 m -64.24 160.88 17.66 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.735 1.214 . . . . 0.0 112.828 -179.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 37.2 mt -72.46 -17.57 61.76 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 -178.19 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -69.1 148.92 97.77 Favored Pre-proline 0 CA--C 1.551 0.998 0 C-N-CA 124.522 1.129 . . . . 0.0 112.48 178.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -69.55 -20.29 36.0 Favored 'Trans proline' 0 CA--C 1.539 0.764 0 C-N-CA 123.144 2.563 . . . . 0.0 113.214 179.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -83.04 0.44 44.85 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 124.803 1.241 . . . . 0.0 113.97 178.126 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.9 167.98 14.56 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.126 1.371 . . . . 0.0 113.928 -175.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -145.77 152.01 38.87 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.81 1.644 . . . . 0.0 109.546 177.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 51.2 mt -75.57 126.95 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 124.187 0.995 . . . . 0.0 111.215 -174.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -78.4 88.49 4.4 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.767 1.227 . . . . 0.0 109.967 169.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -83.79 158.78 21.59 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.914 1.285 . . . . 0.0 111.154 175.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 6.7 t -148.61 -170.0 3.5 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.201 1.0 . . . . 0.0 112.152 173.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 98.8 mt -60.5 128.82 38.55 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.193 1.797 . . . . 0.0 111.754 -174.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.43 154.45 41.34 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.758 1.223 . . . . 0.0 112.73 -171.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.84 167.16 11.19 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 127.069 2.148 . . . . 0.0 110.234 174.239 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -135.06 143.41 46.68 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.026 -1.046 . . . . 0.0 111.781 179.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 60.6 tp -112.17 134.14 53.89 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 125.922 1.689 . . . . 0.0 110.3 172.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 70.8 ttt180 -124.87 117.96 25.26 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.501 1.52 . . . . 0.0 109.615 169.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 29.5 t -100.53 117.7 46.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 124.37 1.068 . . . . 0.0 108.685 169.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 66.8 p -97.44 154.65 17.34 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.698 1.599 . . . . 0.0 111.056 179.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -62.02 141.98 57.76 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.527 0.731 . . . . 0.0 112.629 -176.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 51.8 ttt85 . . . . . 0 N--CA 1.467 0.423 0 C-N-CA 123.914 0.885 . . . . 0.0 110.164 -178.005 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 37.8 m . . . . . 0 N--CA 1.474 0.748 0 CA-C-O 121.094 0.473 . . . . 0.0 111.378 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -116.8 129.23 55.97 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.6 1.96 . . . . 0.0 109.576 170.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 67.8 m -140.79 158.94 64.24 Favored Pre-proline 0 N--CA 1.479 0.98 0 C-N-CA 124.543 1.137 . . . . 0.0 113.14 -170.062 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -67.75 157.5 85.46 Favored 'Cis proline' 0 C--N 1.354 0.833 0 CA-C-N 119.938 1.014 . . . . 0.0 111.398 -5.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -55.03 -25.92 33.67 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.109 0.963 . . . . 0.0 113.5 176.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 43.3 tp -143.5 116.18 8.69 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.582 1.553 . . . . 0.0 108.441 168.698 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 38.0 tp -97.32 127.47 43.31 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.416 1.086 . . . . 0.0 109.018 169.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.8 t -114.04 123.14 69.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 124.067 0.947 . . . . 0.0 108.662 173.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 32.6 m -127.03 162.52 31.72 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 124.529 1.132 . . . . 0.0 112.134 174.013 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 11.6 m -87.52 148.65 24.82 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.378 1.071 . . . . 0.0 110.502 173.076 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -59.2 125.7 24.69 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.019 0.928 . . . . 0.0 111.753 -179.254 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.66 -3.49 85.02 Favored Glycine 0 CA--C 1.532 1.11 0 C-N-CA 125.805 1.669 . . . . 0.0 114.51 -175.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -85.35 156.03 21.07 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 119.601 1.7 . . . . 0.0 110.814 171.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -82.46 134.81 35.22 Favored 'General case' 0 CA--C 1.543 0.68 0 O-C-N 121.405 -0.809 . . . . 0.0 111.24 171.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -104.47 123.64 47.84 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.713 1.605 . . . . 0.0 110.052 177.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 94.7 m -122.9 125.22 44.93 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.41 0.684 . . . . 0.0 110.985 176.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -102.82 159.6 15.34 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 127.264 2.225 . . . . 0.0 110.522 174.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 80.6 m -105.71 130.08 53.79 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.854 1.261 . . . . 0.0 109.997 170.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 54.0 t -110.29 140.5 44.39 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.382 1.473 . . . . 0.0 109.814 168.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 6.1 t -144.38 132.24 21.38 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.355 -0.84 . . . . 0.0 110.534 -178.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 . . . . . 0 N--CA 1.468 0.449 0 C-N-CA 125.645 1.578 . . . . 0.0 113.636 -177.217 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 52.4 p90 . . . . . 0 CA--C 1.54 0.589 0 CA-C-O 120.407 0.146 . . . . 0.0 110.611 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 50.4 t -95.92 125.22 48.78 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.43 1.092 . . . . 0.0 108.268 174.098 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 58.6 tp -101.57 128.9 47.62 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.388 0.675 . . . . 0.0 109.557 169.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 28.8 m-80 -116.64 163.17 16.51 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.637 1.575 . . . . 0.0 111.154 -175.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 19.8 t90 -133.19 138.88 46.73 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.756 1.222 . . . . 0.0 111.832 -178.376 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -137.43 146.56 44.51 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.291 1.436 . . . . 0.0 113.717 -172.073 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 27.7 ttp-105 -104.12 142.62 34.17 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.949 1.7 . . . . 0.0 107.727 167.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 35.4 mtp -88.27 131.47 34.77 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 119.077 0.853 . . . . 0.0 111.027 170.075 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 37.9 m -92.65 155.56 41.84 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 124.807 1.243 . . . . 0.0 111.43 175.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -66.67 -19.32 53.88 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 123.566 2.844 . . . . 0.0 113.775 -175.22 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.7 m -76.94 8.54 3.69 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 124.753 1.221 . . . . 0.0 113.277 171.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 26.4 m120 73.29 21.01 3.13 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 127.851 2.46 . . . . 0.0 113.37 179.231 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 21.9 mm100 -96.7 175.37 6.4 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.669 1.187 . . . . 0.0 111.265 174.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.2 p -126.53 139.84 52.9 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.976 1.71 . . . . 0.0 109.795 175.251 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 41.3 t0 -120.57 130.68 54.31 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 125.323 1.449 . . . . 0.0 110.667 -177.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 41.7 tttm -82.79 123.12 29.04 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.454 1.102 . . . . 0.0 111.415 -171.435 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.5 mt -100.37 -45.65 5.51 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.77 1.228 . . . . 0.0 112.912 -169.069 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -174.05 176.71 2.5 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.337 1.855 . . . . 0.0 110.353 -178.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -157.75 166.29 33.15 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.959 1.303 . . . . 0.0 112.136 -179.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 21.2 t80 -142.17 122.24 8.18 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 125.087 1.355 . . . . 0.0 110.503 172.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo . . . . . 0 C--N 1.352 0.715 0 CA-C-N 119.534 0.869 . . . . 0.0 110.92 -9.363 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 50.6 mtp180 . . . . . 0 N--CA 1.473 0.684 0 CA-C-O 119.127 -0.464 . . . . 0.0 112.049 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 88.6 m-85 -103.23 128.3 50.27 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.554 1.542 . . . . 0.0 110.903 -175.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -142.02 148.04 37.86 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.766 1.227 . . . . 0.0 111.406 -170.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 40.9 t -126.62 136.9 59.47 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 124.976 1.311 . . . . 0.0 110.784 178.497 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 98.0 m -127.81 132.74 49.43 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.494 1.518 . . . . 0.0 110.212 175.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -85.12 136.48 33.53 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.08 0.952 . . . . 0.0 110.46 172.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 29.5 mt -89.59 159.25 44.22 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 124.135 0.974 . . . . 0.0 111.461 176.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -63.65 -6.03 9.83 Favored 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 123.489 2.793 . . . . 0.0 114.216 175.097 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -66.55 -18.99 65.67 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-N 119.224 0.92 . . . . 0.0 112.953 169.391 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 82.72 -34.18 2.76 Favored Glycine 0 N--CA 1.474 1.2 0 C-N-CA 127.386 2.422 . . . . 0.0 114.326 174.222 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 38.1 mtm105 -128.25 73.56 1.49 Allowed 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.097 1.359 . . . . 0.0 108.574 168.534 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -174.22 137.68 0.54 Allowed 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 127.743 2.417 . . . . 0.0 108.03 177.514 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -146.03 148.5 32.77 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 123.461 0.705 . . . . 0.0 112.209 -168.037 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 42.6 m170 -105.43 130.2 53.57 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.71 1.204 . . . . 0.0 111.203 169.325 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -112.0 119.31 38.04 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 126.311 1.844 . . . . 0.0 108.565 178.088 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 60.8 m -121.44 125.66 47.42 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 -169.479 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 25.8 t -96.35 111.11 25.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 125.773 1.629 . . . . 0.0 106.693 168.185 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 62.6 t -81.48 127.92 39.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 123.543 0.737 . . . . 0.0 109.766 177.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 68.0 ttt-85 57.15 67.61 0.96 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.821 1.649 . . . . 0.0 111.273 176.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -72.53 144.42 47.97 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.851 0.86 . . . . 0.0 112.289 -174.137 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 49.0 mmm-85 -123.15 162.23 22.91 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 126.625 1.97 . . . . 0.0 110.352 -177.092 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 77.2 mtm180 -55.66 -23.11 26.33 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 113.66 0.985 . . . . 0.0 113.66 174.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -54.06 -35.67 62.28 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.766 1.626 . . . . 0.0 113.586 168.271 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -87.69 -15.09 38.12 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.304 1.042 . . . . 0.0 113.72 -168.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 50.2 m -58.04 134.66 56.61 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 119.696 1.135 . . . . 0.0 112.273 177.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 146.94 -163.97 28.59 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 124.496 1.046 . . . . 0.0 113.316 -171.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.8 m -95.08 144.85 25.4 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.586 1.154 . . . . 0.0 111.783 -173.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -140.5 156.92 46.18 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.394 1.877 . . . . 0.0 112.254 -179.097 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -164.07 159.16 20.19 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.797 1.639 . . . . 0.0 112.372 179.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 7.3 p -112.49 162.99 15.0 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.543 1.137 . . . . 0.0 112.115 176.037 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -153.35 126.23 1.92 Allowed Glycine 0 N--CA 1.471 1.026 0 O-C-N 121.304 -0.872 . . . . 0.0 114.287 -176.569 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -97.23 148.78 22.75 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.484 1.114 . . . . 0.0 112.715 -177.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 17.8 tt -150.27 138.8 14.78 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 125.402 1.481 . . . . 0.0 110.532 175.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 47.4 t -65.2 158.15 26.91 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.451 -0.781 . . . . 0.0 112.72 176.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -71.76 -8.04 51.79 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 172.542 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -69.77 147.59 96.3 Favored Pre-proline 0 CA--C 1.552 1.04 0 C-N-CA 124.453 1.101 . . . . 0.0 112.275 175.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -71.02 -21.24 27.9 Favored 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 123.17 2.58 . . . . 0.0 113.311 -179.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -87.74 3.5 47.78 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.735 1.214 . . . . 0.0 113.821 179.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.76 167.31 17.42 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.147 1.379 . . . . 0.0 114.126 -173.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -150.45 148.86 29.26 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.221 1.808 . . . . 0.0 109.169 178.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 47.8 mt -77.15 131.12 35.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 124.219 1.008 . . . . 0.0 112.031 -170.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -101.32 117.11 34.31 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.594 1.557 . . . . 0.0 108.284 168.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -94.93 148.86 21.87 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.235 1.014 . . . . 0.0 112.134 -174.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 52.9 p -83.91 169.22 15.29 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.693 1.197 . . . . 0.0 114.074 178.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 94.5 mt -69.06 129.99 41.48 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 166.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 34.3 ptt-85 -84.68 164.15 18.79 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.931 1.292 . . . . 0.0 113.749 -169.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -146.93 163.13 37.14 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.283 1.433 . . . . 0.0 113.488 -177.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -99.13 151.48 20.93 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.726 1.61 . . . . 0.0 112.798 -176.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 61.5 tp -125.58 136.49 53.35 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 126.857 2.063 . . . . 0.0 109.851 169.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -128.11 120.46 27.44 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.7 1.6 . . . . 0.0 109.93 174.031 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 42.9 t -101.95 116.93 46.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 124.512 1.125 . . . . 0.0 108.752 169.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 82.8 p -101.98 145.37 29.37 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.653 1.581 . . . . 0.0 110.716 -178.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -55.36 145.22 22.78 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -175.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 63.7 ttt-85 . . . . . 0 N--CA 1.467 0.389 0 C-N-CA 125.209 1.404 . . . . 0.0 109.772 175.675 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.2 t . . . . . 0 N--CA 1.472 0.658 0 CA-C-O 121.503 0.668 . . . . 0.0 112.202 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -144.97 117.67 8.67 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.347 1.859 . . . . 0.0 109.619 175.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 96.9 p -140.94 161.72 52.29 Favored Pre-proline 0 CA--C 1.55 0.969 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 -169.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -71.71 164.26 84.65 Favored 'Cis proline' 0 C--N 1.354 0.826 0 CA-C-N 119.45 0.839 . . . . 0.0 111.762 -7.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.66 -26.06 68.49 Favored 'General case' 0 CA--C 1.544 0.75 0 N-CA-C 113.048 0.759 . . . . 0.0 113.048 173.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 50.7 tp -144.3 125.68 14.8 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.192 1.797 . . . . 0.0 109.326 172.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 64.7 tp -115.29 125.61 53.48 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.987 1.715 . . . . 0.0 109.266 174.304 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.9 t -110.25 122.98 65.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 124.144 0.978 . . . . 0.0 109.16 175.038 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 32.0 m -129.2 176.22 8.75 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 125.753 1.621 . . . . 0.0 111.861 176.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 26.1 m -103.95 151.68 22.88 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 126.08 1.752 . . . . 0.0 110.402 176.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -53.51 121.98 8.82 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.294 1.038 . . . . 0.0 111.777 171.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.0 2.36 69.1 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 125.442 1.496 . . . . 0.0 114.407 -177.089 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -93.85 149.37 21.29 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.665 1.732 . . . . 0.0 112.544 177.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 21.6 m120 -72.93 113.22 9.72 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.255 1.022 . . . . 0.0 110.757 172.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -97.5 124.99 41.92 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.79 0.836 . . . . 0.0 110.514 177.63 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 32.1 m -129.53 123.27 31.02 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 118.633 0.651 . . . . 0.0 111.53 -173.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -101.55 149.81 23.72 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.609 1.564 . . . . 0.0 110.371 169.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 62.1 m -102.67 126.34 49.73 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.985 1.314 . . . . 0.0 109.475 177.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 37.5 t -124.33 142.05 51.58 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.147 1.379 . . . . 0.0 112.314 175.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 80.7 p -150.59 148.79 29.07 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.146 -0.971 . . . . 0.0 112.133 170.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 . . . . . 0 CA--C 1.537 0.451 0 C-N-CA 126.822 2.049 . . . . 0.0 111.962 178.486 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 55.5 p90 . . . . . 0 CA--C 1.54 0.577 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.7 t -96.03 129.02 46.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 125.179 1.392 . . . . 0.0 107.995 170.058 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 34.1 tp -99.37 140.29 33.77 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.222 1.009 . . . . 0.0 109.968 171.294 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -135.49 146.37 48.08 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.337 1.455 . . . . 0.0 111.02 -170.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 17.3 t90 -118.37 139.9 50.67 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.031 1.332 . . . . 0.0 111.297 177.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -136.99 147.7 46.44 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.725 1.21 . . . . 0.0 113.783 -172.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 74.4 ttt180 -105.68 140.06 39.31 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.41 1.484 . . . . 0.0 108.315 167.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 29.8 mtp -81.82 145.92 30.16 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.011 0.823 . . . . 0.0 112.414 177.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 67.7 m -104.68 148.91 36.83 Favored Pre-proline 0 CA--C 1.544 0.745 0 C-N-CA 125.657 1.583 . . . . 0.0 110.793 173.408 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -67.16 -17.9 50.73 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 123.682 2.921 . . . . 0.0 113.278 -177.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 12.0 m -76.87 19.25 0.3 Allowed 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 125.759 1.624 . . . . 0.0 113.29 171.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 44.8 m-80 68.63 33.84 3.72 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 127.425 2.29 . . . . 0.0 112.587 177.01 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -130.06 -172.68 2.84 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.453 1.501 . . . . 0.0 110.798 -172.121 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.1 p -148.01 145.12 28.38 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.909 1.684 . . . . 0.0 110.215 -171.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -120.12 131.61 55.11 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 124.638 1.175 . . . . 0.0 111.002 175.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -76.17 129.51 36.85 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.561 0.744 . . . . 0.0 111.307 -179.359 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 55.7 mt -101.98 -51.25 3.45 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 125.473 1.509 . . . . 0.0 111.406 -173.165 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -163.4 173.55 13.05 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.822 1.649 . . . . 0.0 110.387 -175.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.6 168.39 26.21 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.508 1.123 . . . . 0.0 112.759 -174.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 52.3 t80 -142.73 122.8 7.98 Favored Pre-proline 0 CA--C 1.546 0.8 0 C-N-CA 124.992 1.317 . . . . 0.0 110.332 169.439 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo . . . . . 0 C--N 1.351 0.705 0 CA-C-N 119.683 0.922 . . . . 0.0 111.399 -8.648 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 . . . . . 0 N--CA 1.474 0.726 0 N-CA-C 113.693 0.997 . . . . 0.0 113.693 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -90.15 124.94 35.25 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.04 0.936 . . . . 0.0 112.944 -168.111 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 23.4 mmt85 -129.82 156.63 44.03 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.84 1.656 . . . . 0.0 111.831 178.137 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 87.7 t -126.6 130.53 71.69 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 C-N-CA 125.65 1.58 . . . . 0.0 109.771 169.774 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 97.8 m -126.0 132.0 52.11 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 125.08 1.352 . . . . 0.0 110.16 177.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 63.0 tt0 -84.64 138.02 32.93 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.597 1.159 . . . . 0.0 111.043 177.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 28.6 mt -91.55 162.37 31.78 Favored Pre-proline 0 CA--C 1.548 0.877 0 C-N-CA 124.102 0.961 . . . . 0.0 112.063 176.31 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -56.03 -20.88 32.02 Favored 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 124.213 3.276 . . . . 0.0 114.211 172.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 21.7 m120 -60.74 -18.44 54.6 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 176.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 90.48 -34.06 4.32 Favored Glycine 0 N--CA 1.474 1.196 0 C-N-CA 126.569 2.033 . . . . 0.0 114.549 169.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 26.0 ptt-85 -138.8 73.58 1.44 Allowed 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 123.883 1.802 . . . . 0.0 109.72 168.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -164.53 137.33 4.84 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 127.872 2.469 . . . . 0.0 106.52 -179.058 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -144.75 143.47 30.69 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -166.628 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -96.69 116.03 28.43 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.973 1.309 . . . . 0.0 110.322 168.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -94.55 108.05 20.01 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 126.558 1.943 . . . . 0.0 107.621 174.336 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 19.4 m -116.51 126.99 54.14 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.847 1.055 . . . . 0.0 113.847 -167.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 21.3 t -94.66 104.83 16.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 N-CA-C 106.722 -1.584 . . . . 0.0 106.722 168.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 81.0 t -70.4 121.08 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 124.647 1.179 . . . . 0.0 109.731 179.442 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 51.87 57.27 6.7 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.793 1.637 . . . . 0.0 112.039 176.32 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -59.57 140.04 56.66 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.254 1.422 . . . . 0.0 112.056 -173.086 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 19.8 mmm-85 -115.05 168.31 10.04 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.641 1.576 . . . . 0.0 110.508 177.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 59.0 mtp85 -51.2 -35.29 35.78 Favored 'General case' 0 N--CA 1.479 0.997 0 O-C-N 121.023 -1.048 . . . . 0.0 112.855 176.149 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -57.43 -22.59 44.26 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.14 1.776 . . . . 0.0 114.994 173.115 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -86.68 -10.88 52.78 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.774 1.229 . . . . 0.0 113.53 177.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 65.4 m -63.97 137.74 58.14 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 120.196 -1.565 . . . . 0.0 112.312 -179.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 152.23 -166.7 31.14 Favored Glycine 0 N--CA 1.47 0.901 0 C-N-CA 123.996 0.808 . . . . 0.0 113.298 -179.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.6 m -93.63 141.79 28.08 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.367 1.067 . . . . 0.0 110.467 -176.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -136.05 160.12 39.6 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.548 1.939 . . . . 0.0 110.972 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.7 pp -154.09 163.52 39.96 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 121.12 -0.988 . . . . 0.0 112.262 174.036 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 34.6 t -124.59 141.18 52.29 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.288 1.435 . . . . 0.0 110.494 -177.125 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -150.24 143.78 11.11 Favored Glycine 0 N--CA 1.47 0.96 0 N-CA-C 114.938 0.735 . . . . 0.0 114.938 -175.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -115.86 154.3 29.96 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.009 1.324 . . . . 0.0 113.04 -177.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 17.2 tt -146.64 133.29 13.85 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 125.344 1.458 . . . . 0.0 110.469 176.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 31.7 p -71.47 161.55 30.85 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.124 0.97 . . . . 0.0 113.427 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 47.3 mt -75.22 -3.42 32.98 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 114.233 1.197 . . . . 0.0 114.233 -179.047 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -67.8 151.69 96.97 Favored Pre-proline 0 CA--C 1.551 0.986 0 C-N-CA 124.729 1.212 . . . . 0.0 112.612 178.193 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -69.29 -23.9 32.43 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 122.939 2.426 . . . . 0.0 112.693 175.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 57.2 mtmt -92.39 10.28 30.61 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.247 1.419 . . . . 0.0 113.591 178.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -64.23 161.62 16.18 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.815 1.246 . . . . 0.0 114.014 -175.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 25.9 tt0 -147.07 149.02 32.26 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.02 1.728 . . . . 0.0 109.105 179.037 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 58.1 mt -77.21 123.93 34.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 123.181 0.592 . . . . 0.0 110.967 -176.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -93.99 137.84 32.76 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.506 1.522 . . . . 0.0 108.709 168.19 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -120.06 142.41 48.88 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.098 0.959 . . . . 0.0 111.797 -175.29 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 23.7 m -89.65 167.13 13.16 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.192 0.997 . . . . 0.0 112.251 169.56 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.4 139.38 58.21 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.12 0.968 . . . . 0.0 110.665 176.202 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.57 151.88 44.55 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -172.838 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.87 161.12 19.25 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.062 1.745 . . . . 0.0 111.347 174.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -120.95 135.46 55.2 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.036 1.334 . . . . 0.0 110.016 176.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 46.3 tp -107.79 128.82 54.93 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 125.622 1.569 . . . . 0.0 109.724 173.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 4.5 tpm_? -123.83 113.14 18.14 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.122 1.769 . . . . 0.0 109.203 177.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 16.3 t -106.85 114.48 46.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 123.628 0.771 . . . . 0.0 109.799 176.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 70.2 p -95.25 159.27 15.09 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.43 1.892 . . . . 0.0 111.593 -176.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -67.57 141.48 56.8 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.433 0.693 . . . . 0.0 112.168 -178.184 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 68.9 ttp85 . . . . . 0 N--CA 1.466 0.338 0 C-N-CA 124.419 1.088 . . . . 0.0 110.113 178.199 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 13.7 t . . . . . 0 N--CA 1.467 0.401 0 CA-C-O 121.433 0.635 . . . . 0.0 112.023 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -143.92 113.88 7.27 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 127.535 2.334 . . . . 0.0 107.982 178.332 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 95.1 p -140.83 159.61 61.71 Favored Pre-proline 0 CA--C 1.55 0.951 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 -168.662 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.22 161.72 84.06 Favored 'Cis proline' 0 C--N 1.355 0.916 0 CA-C-N 119.419 0.828 . . . . 0.0 111.598 -6.73 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.43 -27.86 69.29 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 175.062 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 tt -132.57 115.36 15.36 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 126.453 1.901 . . . . 0.0 108.71 173.847 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.7 tp -107.15 121.18 43.99 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.933 0.893 . . . . 0.0 109.63 172.092 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.0 t -106.38 125.54 62.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 124.132 0.973 . . . . 0.0 108.661 172.737 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.9 m -129.42 166.67 26.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 124.363 1.065 . . . . 0.0 111.422 169.804 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 73.6 m -88.76 150.33 23.0 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.26 1.024 . . . . 0.0 110.344 170.424 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -53.81 116.9 2.77 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.551 1.541 . . . . 0.0 111.313 173.335 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 89.67 8.31 67.82 Favored Glycine 0 CA--C 1.534 1.247 0 CA-C-O 118.547 -1.141 . . . . 0.0 114.62 -176.295 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -99.5 155.34 17.62 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 119.408 1.604 . . . . 0.0 111.96 171.484 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -78.5 119.56 21.96 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.99 0.916 . . . . 0.0 110.969 179.895 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -98.91 126.72 44.66 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.685 1.194 . . . . 0.0 110.749 175.941 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 97.7 m -132.78 125.6 30.49 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.774 0.83 . . . . 0.0 111.61 179.74 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -100.05 154.16 18.64 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.837 1.655 . . . . 0.0 109.441 168.191 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.3 m -106.52 134.26 49.93 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.689 1.195 . . . . 0.0 109.369 173.493 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 43.2 t -126.39 139.63 53.12 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.637 1.575 . . . . 0.0 111.959 176.156 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 99.2 p -151.23 153.38 34.79 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 121.437 -0.79 . . . . 0.0 112.132 170.594 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 . . . . . 0 CA--C 1.533 0.311 0 C-N-CA 125.787 1.635 . . . . 0.0 113.336 -174.778 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 35.6 p90 . . . . . 0 CA--C 1.538 0.489 0 CA-C-O 120.698 0.285 . . . . 0.0 110.784 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 79.2 t -95.87 123.14 47.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 170.091 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 22.3 tp -100.06 136.12 40.45 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.908 0.883 . . . . 0.0 109.776 176.564 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -130.71 154.69 47.68 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.689 1.596 . . . . 0.0 111.003 -169.746 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 19.3 t90 -130.9 137.68 49.43 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.755 1.222 . . . . 0.0 111.689 -177.351 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -136.15 146.43 46.89 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.53 1.132 . . . . 0.0 112.998 -173.058 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.6 ttt180 -103.71 140.88 37.0 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.962 1.305 . . . . 0.0 108.48 167.823 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 28.5 mtp -87.08 140.75 29.24 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.4 0.68 . . . . 0.0 111.931 176.719 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 48.6 m -91.94 157.62 40.98 Favored Pre-proline 0 CA--C 1.549 0.913 0 C-N-CA 124.714 1.206 . . . . 0.0 111.91 176.514 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -55.62 -34.01 88.85 Favored 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 123.957 3.104 . . . . 0.0 114.09 176.485 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.6 m -76.92 9.63 2.8 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.063 1.345 . . . . 0.0 113.855 176.935 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 26.5 m120 70.5 20.9 5.74 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 127.329 2.252 . . . . 0.0 113.386 -178.971 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -90.1 -172.67 3.57 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.555 1.142 . . . . 0.0 110.582 170.432 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.1 p -145.13 147.35 32.4 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.768 1.627 . . . . 0.0 110.488 -175.512 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -123.9 133.3 53.77 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 124.731 1.212 . . . . 0.0 111.235 174.16 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -79.92 118.8 22.0 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.916 0.886 . . . . 0.0 111.21 -178.03 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 61.8 mt -89.25 -53.75 4.42 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 125.002 1.321 . . . . 0.0 111.172 -173.709 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -165.4 172.15 12.55 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.854 1.662 . . . . 0.0 110.552 -174.797 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.59 167.81 27.6 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.27 1.428 . . . . 0.0 111.628 -178.094 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -156.22 135.08 7.67 Favored Pre-proline 0 CA--C 1.551 1.011 0 C-N-CA 123.998 0.919 . . . . 0.0 112.974 170.239 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo . . . . . 0 C--N 1.354 0.817 0 N-CA-C 108.98 -1.2 . . . . 0.0 108.98 -14.322 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 25.7 ptt-85 . . . . . 0 N--CA 1.471 0.581 0 N-CA-C 114.694 1.368 . . . . 0.0 114.694 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -91.02 117.74 29.82 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.47 1.108 . . . . 0.0 110.317 177.805 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -139.09 152.31 47.41 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.417 1.087 . . . . 0.0 112.343 -169.49 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 82.4 t -126.47 128.94 71.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 C-N-CA 125.841 1.656 . . . . 0.0 109.376 177.647 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 96.7 m -128.0 133.47 49.16 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.233 1.413 . . . . 0.0 110.332 -176.466 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -80.65 141.79 34.61 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.001 0.92 . . . . 0.0 112.136 176.608 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 27.2 mt -90.84 158.39 42.21 Favored Pre-proline 0 CA--C 1.545 0.764 0 C-N-CA 124.06 0.944 . . . . 0.0 111.456 172.172 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -65.23 -6.21 12.73 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.529 2.819 . . . . 0.0 114.18 174.623 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -63.0 -26.0 68.65 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 119.527 1.058 . . . . 0.0 112.66 169.436 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 98.69 -34.16 5.53 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 126.231 1.872 . . . . 0.0 114.379 172.611 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 40.6 mtm180 -136.22 73.65 1.47 Allowed 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 118.654 1.227 . . . . 0.0 109.837 170.41 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -168.81 139.83 2.49 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 128.254 2.622 . . . . 0.0 107.397 -176.861 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -143.44 149.85 38.19 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 114.457 1.28 . . . . 0.0 114.457 -167.92 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -102.08 128.67 48.45 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.622 1.569 . . . . 0.0 110.45 168.286 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -106.49 113.11 26.43 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 127.039 2.136 . . . . 0.0 108.071 176.11 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 52.9 m -121.88 132.42 54.56 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 114.817 1.414 . . . . 0.0 114.817 -167.763 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 21.9 t -102.04 104.43 16.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 167.469 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 88.1 t -69.59 126.99 30.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 123.725 0.81 . . . . 0.0 109.858 179.124 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 47.17 59.28 4.15 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.878 1.671 . . . . 0.0 112.327 177.854 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -59.92 137.7 58.01 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.049 1.34 . . . . 0.0 112.737 -170.018 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 36.5 mtp180 -100.01 158.49 15.79 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.914 1.685 . . . . 0.0 109.889 -176.91 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 20.1 mtp180 -58.92 -29.08 66.82 Favored 'General case' 0 N--CA 1.484 1.236 0 O-C-N 120.846 -1.159 . . . . 0.0 112.576 176.039 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -51.23 -30.53 17.72 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.534 1.934 . . . . 0.0 113.948 168.559 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 47.4 m-20 -90.3 -8.89 49.74 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.893 1.277 . . . . 0.0 113.119 -169.693 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 50.4 m -62.98 138.88 58.69 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.058 -1.026 . . . . 0.0 112.202 177.302 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 149.72 -170.15 29.87 Favored Glycine 0 N--CA 1.472 1.095 0 C-N-CA 124.669 1.128 . . . . 0.0 113.0 -177.029 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.6 m -89.34 140.98 28.96 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.136 0.974 . . . . 0.0 110.698 -177.517 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -132.15 160.98 34.46 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.949 2.1 . . . . 0.0 110.478 176.702 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -156.64 161.57 39.89 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.676 1.19 . . . . 0.0 112.33 175.496 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 23.6 t -113.81 151.36 32.17 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.685 1.594 . . . . 0.0 111.093 -178.006 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -152.57 136.8 5.56 Favored Glycine 0 N--CA 1.473 1.165 0 C-N-CA 124.082 0.848 . . . . 0.0 113.688 -179.529 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -111.33 153.81 25.44 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 118.352 1.076 . . . . 0.0 112.659 -179.22 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.8 tt -141.19 132.56 28.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.664 1.186 . . . . 0.0 110.44 170.414 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 29.6 t -65.22 161.57 19.04 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.805 1.242 . . . . 0.0 113.85 -175.216 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 3.1 pp -64.38 -12.65 44.83 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.445 1.498 . . . . 0.0 114.971 176.654 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -78.42 141.11 60.88 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 124.401 1.081 . . . . 0.0 112.398 -178.514 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_exo -56.59 -28.78 76.26 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.409 2.739 . . . . 0.0 114.319 173.203 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -81.92 -1.52 48.17 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.259 1.424 . . . . 0.0 113.861 -178.947 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.03 164.65 12.42 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 114.387 1.254 . . . . 0.0 114.387 -174.478 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -145.03 154.78 42.88 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.419 1.888 . . . . 0.0 108.81 176.466 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 55.8 mt -72.86 121.63 23.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 123.62 0.768 . . . . 0.0 111.328 -173.887 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -92.72 123.61 36.12 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.084 1.754 . . . . 0.0 108.944 169.071 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -87.31 145.2 26.44 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.818 0.847 . . . . 0.0 111.96 -179.005 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 5.2 t -92.77 -165.45 1.34 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.055 1.342 . . . . 0.0 112.002 170.065 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 87.3 mt -68.2 158.94 32.13 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.015 1.326 . . . . 0.0 111.206 169.895 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.29 147.46 31.42 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.76 1.224 . . . . 0.0 111.209 170.14 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -144.3 155.77 43.97 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.588 1.555 . . . . 0.0 111.342 -177.734 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -102.87 141.39 35.75 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 178.582 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 54.7 tp -99.6 131.75 45.39 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 126.836 2.054 . . . . 0.0 108.662 168.956 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 28.7 ttm180 -127.28 110.84 13.25 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.703 1.601 . . . . 0.0 109.429 -179.989 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 42.6 t -101.37 116.47 45.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 124.501 1.12 . . . . 0.0 108.84 177.519 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 72.8 p -98.1 147.79 24.2 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.628 1.571 . . . . 0.0 110.652 -178.635 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -59.53 139.81 56.82 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.267 0.627 . . . . 0.0 111.76 -177.824 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 79.1 ttt-85 . . . . . 0 C--O 1.236 0.353 0 C-N-CA 123.794 0.837 . . . . 0.0 110.311 -178.397 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.7 t . . . . . 0 N--CA 1.472 0.67 0 CA-C-O 120.993 0.425 . . . . 0.0 111.576 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -161.85 111.99 1.59 Allowed 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 126.034 1.734 . . . . 0.0 109.873 177.584 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 90.0 p -141.03 161.55 53.06 Favored Pre-proline 0 CA--C 1.549 0.918 0 C-N-CA 124.618 1.167 . . . . 0.0 114.097 -174.643 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -75.71 162.83 91.61 Favored 'Cis proline' 0 C--N 1.352 0.746 0 CA-C-N 118.952 0.662 . . . . 0.0 111.456 -10.073 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.69 -25.88 67.52 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 171.868 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 40.4 tp -140.51 118.83 12.1 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 125.907 1.683 . . . . 0.0 109.012 170.688 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 50.6 tp -103.56 129.64 50.83 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.817 1.247 . . . . 0.0 109.127 169.971 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 14.0 p -112.78 128.99 69.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 123.931 0.892 . . . . 0.0 110.271 170.05 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 27.5 m -128.47 166.43 25.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 125.47 1.508 . . . . 0.0 111.865 172.911 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.6 m -90.98 148.43 22.42 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.828 1.251 . . . . 0.0 110.38 173.511 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -54.24 122.03 9.45 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.395 1.478 . . . . 0.0 111.533 176.906 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.73 -1.44 78.47 Favored Glycine 0 CA--C 1.535 1.303 0 C-N-CA 125.585 1.564 . . . . 0.0 114.897 -176.972 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -88.94 159.41 17.66 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.439 1.62 . . . . 0.0 111.381 171.748 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -87.84 135.06 33.55 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.533 -0.729 . . . . 0.0 111.474 171.476 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -108.02 129.91 55.1 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.909 1.683 . . . . 0.0 110.534 179.346 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 39.5 m -132.88 130.22 39.42 Favored 'General case' 0 N--CA 1.476 0.866 0 CA-C-N 119.256 0.935 . . . . 0.0 112.032 178.908 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -102.03 157.66 16.71 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.798 2.039 . . . . 0.0 110.894 172.259 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 46.8 m -113.02 139.75 48.41 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 125.994 1.718 . . . . 0.0 110.058 178.571 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 53.6 t -150.34 149.36 29.98 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.068 1.347 . . . . 0.0 113.08 -177.608 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 8.1 t -154.1 161.76 41.67 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.597 1.159 . . . . 0.0 112.56 169.38 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 . . . . . 0 N--CA 1.47 0.561 0 C-N-CA 126.946 2.098 . . . . 0.0 112.228 -178.314 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 54.6 p90 . . . . . 0 CA--C 1.537 0.46 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.1 t -106.87 136.57 41.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 126.1 1.76 . . . . 0.0 106.917 167.689 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.6 tt -109.64 134.94 51.36 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.509 0.723 . . . . 0.0 109.777 174.845 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -133.35 160.92 35.92 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -166.14 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 67.2 t-105 -115.54 131.65 56.87 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 126.532 1.933 . . . . 0.0 110.877 169.593 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -122.53 156.29 34.48 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.052 1.341 . . . . 0.0 111.956 179.298 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 43.6 ttt-85 -112.84 142.84 45.03 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 126.06 1.744 . . . . 0.0 109.871 169.451 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 67.2 mmm -75.78 142.52 42.3 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.84 0.856 . . . . 0.0 112.384 173.843 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.7 p -90.76 163.61 29.41 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 124.585 1.154 . . . . 0.0 111.101 168.698 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -69.66 -11.09 30.23 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 122.903 2.402 . . . . 0.0 113.086 173.204 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.0 t -94.78 8.09 43.74 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.879 1.272 . . . . 0.0 112.401 172.883 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 64.2 t30 68.84 21.89 7.46 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.744 2.018 . . . . 0.0 113.096 -178.635 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -93.19 -175.05 3.72 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.286 1.034 . . . . 0.0 109.502 169.382 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 11.9 p -138.94 150.41 45.88 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.278 1.031 . . . . 0.0 112.004 -172.859 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -133.96 133.8 41.79 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.081 0.953 . . . . 0.0 111.816 173.403 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -77.3 127.91 33.41 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.735 0.814 . . . . 0.0 111.502 -178.019 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 18.9 mt -106.56 -32.07 8.22 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.901 0.881 . . . . 0.0 113.296 178.65 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -154.57 161.45 41.61 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.303 1.441 . . . . 0.0 111.87 -177.056 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.57 166.31 31.05 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.503 1.121 . . . . 0.0 113.23 -179.133 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -144.24 114.28 5.31 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 126.544 1.937 . . . . 0.0 109.597 174.619 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo . . . . . 0 CA--C 1.538 0.707 0 CA-C-N 119.546 0.874 . . . . 0.0 112.761 -11.128 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 36.3 mtp-105 . . . . . 0 N--CA 1.47 0.525 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -85.21 139.32 31.75 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.444 1.098 . . . . 0.0 109.808 171.935 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 83.2 mtm180 -144.44 149.36 35.9 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.25 1.42 . . . . 0.0 111.605 -173.568 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 77.8 t -126.54 130.93 71.76 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 125.377 1.471 . . . . 0.0 108.409 168.988 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 58.7 m -128.82 138.76 52.24 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.871 1.268 . . . . 0.0 110.59 -174.85 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 27.0 tt0 -97.86 136.62 37.9 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.689 1.195 . . . . 0.0 110.215 170.898 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -97.36 159.87 30.19 Favored Pre-proline 0 CA--C 1.546 0.812 0 C-N-CA 125.427 1.491 . . . . 0.0 111.489 -170.431 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -66.68 -11.1 30.5 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 123.593 2.862 . . . . 0.0 114.056 -178.405 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 22.2 m120 -66.29 -19.33 65.79 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 119.087 0.858 . . . . 0.0 113.052 170.548 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 91.16 -33.87 4.53 Favored Glycine 0 N--CA 1.474 1.229 0 C-N-CA 126.391 1.948 . . . . 0.0 114.377 169.934 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 95.4 mtm-85 -129.06 73.72 1.53 Allowed 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.718 1.607 . . . . 0.0 108.659 169.594 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -170.15 141.6 2.13 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 127.341 2.257 . . . . 0.0 109.278 -178.787 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -145.46 150.36 36.34 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.624 0.726 . . . . 0.0 112.613 -169.725 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -118.98 149.49 41.53 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.421 1.488 . . . . 0.0 111.373 171.321 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.5 mpt? -128.4 124.93 37.54 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.191 0.996 . . . . 0.0 109.358 171.37 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.1 t -124.6 148.29 47.96 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -168.817 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 17.0 t -125.09 105.94 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 127.128 2.171 . . . . 0.0 107.817 176.001 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 96.1 t -80.06 131.43 34.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 124.362 1.065 . . . . 0.0 111.152 -174.997 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 48.8 ttt85 53.4 61.3 3.2 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.917 1.687 . . . . 0.0 111.278 176.002 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.4 129.31 39.56 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.426 1.091 . . . . 0.0 110.844 -172.964 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 12.7 mmt-85 -100.6 167.99 9.99 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.765 1.626 . . . . 0.0 109.511 174.464 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 90.9 mtm-85 -55.56 -34.47 64.78 Favored 'General case' 0 N--CA 1.479 1.015 0 O-C-N 120.922 -1.111 . . . . 0.0 113.009 -178.877 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 34.5 t30 -62.1 -23.79 66.74 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.395 1.478 . . . . 0.0 114.514 174.87 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -80.36 -5.72 56.86 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.087 0.955 . . . . 0.0 112.82 176.258 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 24.4 m -65.49 136.43 56.42 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 120.405 -1.434 . . . . 0.0 110.99 169.943 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 160.07 -165.44 34.76 Favored Glycine 0 N--CA 1.467 0.732 0 O-C-N 121.558 -0.714 . . . . 0.0 113.241 -177.267 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.1 m -107.87 132.22 53.68 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.088 0.955 . . . . 0.0 110.338 -175.933 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -140.71 168.11 20.58 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.661 1.585 . . . . 0.0 111.759 -174.123 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -159.99 151.02 19.25 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 115.013 1.486 . . . . 0.0 115.013 -177.034 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 46.4 t -88.77 136.96 32.73 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.964 2.106 . . . . 0.0 111.275 173.814 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -159.02 135.19 4.08 Favored Glycine 0 N--CA 1.475 1.249 0 N-CA-C 115.402 0.921 . . . . 0.0 115.402 174.859 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -99.0 159.21 15.12 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.34 1.456 . . . . 0.0 112.501 176.393 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 19.0 tt -150.97 134.78 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 125.245 1.418 . . . . 0.0 110.749 178.539 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 41.7 t -64.69 159.66 21.65 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.057 0.943 . . . . 0.0 113.105 177.279 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 44.1 mt -75.51 -12.15 60.17 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.298 0.851 . . . . 0.0 113.298 172.324 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -65.14 147.01 98.84 Favored Pre-proline 0 CA--C 1.552 1.03 0 C-N-CA 124.036 0.934 . . . . 0.0 112.775 -179.432 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -56.5 -30.32 81.91 Favored 'Trans proline' 0 C--N 1.354 0.836 0 C-N-CA 123.511 2.807 . . . . 0.0 114.208 174.142 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 60.2 mtpt -88.35 5.98 39.43 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.193 1.397 . . . . 0.0 113.975 -178.197 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -61.18 153.31 26.33 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 -173.617 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -137.06 159.05 43.04 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.396 1.878 . . . . 0.0 108.744 174.365 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 45.2 mt -78.82 123.7 36.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 O-C-N 121.72 -0.613 . . . . 0.0 110.572 -175.939 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -97.03 104.06 16.04 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 126.106 1.762 . . . . 0.0 108.251 169.065 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -123.06 158.81 29.78 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.994 1.318 . . . . 0.0 113.868 -169.056 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 53.3 m -97.92 159.08 15.16 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.373 1.069 . . . . 0.0 112.14 171.748 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 10.6 mp -63.7 130.39 44.03 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.951 0.9 . . . . 0.0 110.953 -177.674 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.21 145.69 36.4 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.85 1.426 . . . . 0.0 114.85 -170.046 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -125.91 162.89 24.16 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.739 2.015 . . . . 0.0 112.067 -176.259 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -106.31 141.48 37.57 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.938 1.295 . . . . 0.0 112.375 -172.406 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 52.5 tp -115.41 131.58 56.89 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 126.332 1.853 . . . . 0.0 109.114 169.656 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 62.3 ttm-85 -124.07 123.48 40.42 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.794 1.638 . . . . 0.0 110.367 177.638 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 40.0 t -107.8 114.02 45.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 125.037 1.335 . . . . 0.0 109.272 172.676 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 73.0 p -95.11 152.2 18.55 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.509 1.524 . . . . 0.0 110.705 178.142 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -60.02 144.54 49.08 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.617 0.767 . . . . 0.0 112.679 -176.698 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 31.7 tpt85 . . . . . 0 C--O 1.235 0.312 0 C-N-CA 124.269 1.028 . . . . 0.0 109.239 175.624 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.9 t . . . . . 0 N--CA 1.481 1.123 0 CA-C-O 120.317 0.103 . . . . 0.0 111.211 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -125.03 133.64 52.87 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.803 1.641 . . . . 0.0 110.121 -178.538 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 93.6 p -140.96 155.19 68.95 Favored Pre-proline 0 CA--C 1.551 0.981 0 N-CA-C 114.511 1.3 . . . . 0.0 114.511 -176.756 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -68.96 162.03 82.66 Favored 'Cis proline' 0 C--N 1.353 0.766 0 CA-C-N 119.101 0.715 . . . . 0.0 111.511 -7.422 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.33 -32.61 70.24 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 122.803 0.441 . . . . 0.0 112.169 173.119 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 50.1 tp -140.23 120.41 13.81 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 125.452 1.501 . . . . 0.0 109.294 171.175 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 55.8 tp -100.6 125.89 47.02 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.439 1.496 . . . . 0.0 109.003 170.104 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.8 t -108.82 125.64 65.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 171.203 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 27.7 m -128.69 163.4 33.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 124.775 1.23 . . . . 0.0 110.83 173.014 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 52.7 m -88.21 146.95 25.1 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.592 0.757 . . . . 0.0 110.097 169.911 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -54.36 123.04 11.73 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.289 1.436 . . . . 0.0 111.074 174.822 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.08 3.52 72.97 Favored Glycine 0 CA--C 1.532 1.111 0 C-N-CA 125.863 1.697 . . . . 0.0 114.9 -174.733 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -90.26 157.02 17.88 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 119.612 1.706 . . . . 0.0 111.376 169.214 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -85.49 119.77 26.21 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.763 0.825 . . . . 0.0 109.957 174.628 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -98.84 129.62 45.23 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.466 1.107 . . . . 0.0 110.752 -179.246 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 89.9 m -132.73 131.46 41.24 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 119.352 0.978 . . . . 0.0 111.692 177.392 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -102.93 155.93 18.02 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.381 1.873 . . . . 0.0 111.089 172.52 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.6 m -98.68 136.03 39.32 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 125.402 1.481 . . . . 0.0 107.887 168.874 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 35.7 t -138.1 124.68 20.83 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 124.639 1.176 . . . . 0.0 110.308 -179.704 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 75.6 m -116.14 143.89 44.88 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 124.228 1.011 . . . . 0.0 111.094 -173.219 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 . . . . . 0 N--CA 1.465 0.288 0 C-N-CA 125.185 1.394 . . . . 0.0 113.694 170.026 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 53.9 p90 . . . . . 0 CA--C 1.538 0.514 0 CA-C-O 120.946 0.403 . . . . 0.0 111.946 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.6 t -95.98 128.24 47.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 171.466 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -112.77 118.67 35.61 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 125.379 1.471 . . . . 0.0 108.687 -177.123 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -116.48 155.24 28.96 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.921 1.688 . . . . 0.0 111.636 -169.438 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 13.6 t90 -124.32 138.57 54.37 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.726 1.211 . . . . 0.0 112.29 179.941 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 53.7 m-85 -136.65 145.61 45.01 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.031 1.333 . . . . 0.0 113.528 -174.973 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 78.9 ttt-85 -106.42 142.0 36.8 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.683 1.593 . . . . 0.0 108.414 167.833 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 37.1 mtp -86.73 145.37 26.69 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 119.034 0.833 . . . . 0.0 112.624 177.864 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.6 m -92.41 159.13 37.57 Favored Pre-proline 0 CA--C 1.547 0.86 0 C-N-CA 125.056 1.342 . . . . 0.0 111.999 175.755 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -57.79 -25.73 70.23 Favored 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 124.102 3.201 . . . . 0.0 114.224 174.412 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 33.5 p -77.06 -0.56 25.11 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.474 1.91 . . . . 0.0 114.017 174.943 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 71.16 20.87 4.99 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 127.178 2.191 . . . . 0.0 112.442 -173.111 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 20.5 mm100 -88.3 -172.67 3.88 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.033 0.933 . . . . 0.0 110.083 168.99 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.7 p -141.35 150.1 42.0 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.761 1.624 . . . . 0.0 110.628 -175.817 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -128.15 132.26 48.91 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.786 1.234 . . . . 0.0 111.032 176.909 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 57.0 tttt -79.76 132.47 36.17 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.372 0.669 . . . . 0.0 111.644 -176.639 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 67.9 mt -106.88 -46.09 4.03 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.077 1.351 . . . . 0.0 112.487 -169.921 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -174.15 175.95 2.61 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 127.175 2.19 . . . . 0.0 110.089 -174.478 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.63 167.7 27.83 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.888 1.275 . . . . 0.0 112.318 -179.363 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -129.33 144.0 51.06 Favored Pre-proline 0 CA--C 1.549 0.909 0 C-N-CA 126.181 1.792 . . . . 0.0 110.226 169.808 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_exo . . . . . 0 C--N 1.356 0.969 0 N-CA-C 116.352 1.635 . . . . 0.0 116.352 2.755 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 46.5 mtp85 . . . . . 0 N--CA 1.471 0.582 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 -101.43 142.32 32.99 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.139 1.775 . . . . 0.0 112.013 -172.673 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 65.3 ttt180 -143.48 144.36 31.96 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.63 1.572 . . . . 0.0 111.27 178.475 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 57.6 t -120.34 132.56 69.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 125.663 1.585 . . . . 0.0 109.08 169.707 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 25.0 m -126.66 133.79 50.89 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.922 1.289 . . . . 0.0 109.858 177.11 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -84.86 138.38 32.58 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.398 0.679 . . . . 0.0 110.67 172.481 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 41.5 mt -85.07 159.61 56.65 Favored Pre-proline 0 CA--C 1.544 0.717 0 C-N-CA 124.863 1.265 . . . . 0.0 111.771 179.247 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -63.03 -5.91 8.61 Favored 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 123.675 2.917 . . . . 0.0 113.95 174.012 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 23.2 m120 -60.93 -25.22 66.62 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.191 0.996 . . . . 0.0 112.852 169.251 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 89.23 -16.51 55.67 Favored Glycine 0 N--CA 1.476 1.308 0 C-N-CA 125.53 1.538 . . . . 0.0 114.768 174.427 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.6 ptp180 -154.57 73.69 0.91 Allowed 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 126.198 1.799 . . . . 0.0 109.487 169.816 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -173.73 148.67 1.5 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 128.378 2.671 . . . . 0.0 108.55 -178.642 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -146.66 153.48 40.35 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.796 1.035 . . . . 0.0 113.796 -166.844 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -116.33 141.75 47.75 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.887 1.675 . . . . 0.0 110.065 168.115 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 42.5 mtt -130.73 115.29 16.45 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 124.629 1.172 . . . . 0.0 110.546 -173.924 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 43.7 m -116.02 134.03 55.39 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.36 1.245 . . . . 0.0 114.36 -167.749 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 17.1 t -104.56 113.72 42.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 126.569 1.948 . . . . 0.0 106.825 167.865 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 4.0 p -77.48 133.61 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 122.513 0.325 . . . . 0.0 110.755 -179.911 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 45.92 64.11 1.59 Allowed 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 125.491 1.516 . . . . 0.0 112.08 174.12 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.02 144.41 57.3 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.368 1.067 . . . . 0.0 112.994 -169.694 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 54.3 mtp85 -114.87 158.33 22.1 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 126.598 1.959 . . . . 0.0 110.036 -176.393 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 91.0 mtm-85 -53.6 -32.62 51.87 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 -178.833 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -70.84 -18.82 62.7 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 115.676 1.732 . . . . 0.0 115.676 176.613 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -73.2 -25.55 60.81 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 119.566 1.076 . . . . 0.0 112.045 178.769 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 14.8 m -51.35 139.44 19.32 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.979 1.312 . . . . 0.0 112.905 178.923 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 152.09 -166.6 31.04 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 124.338 0.971 . . . . 0.0 113.023 -175.777 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.5 m -92.36 143.88 25.94 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.9 1.28 . . . . 0.0 110.167 -179.617 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -138.39 156.55 47.49 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.931 1.692 . . . . 0.0 111.719 -177.606 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -163.06 157.09 20.34 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.06 1.344 . . . . 0.0 112.4 177.527 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 5.6 m -100.51 162.98 12.57 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.997 0.919 . . . . 0.0 111.85 172.724 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -145.21 130.19 3.76 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 124.392 0.996 . . . . 0.0 112.163 169.437 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -111.65 145.0 40.0 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 118.41 1.105 . . . . 0.0 112.327 178.437 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.4 tt -141.34 133.58 29.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.236 1.414 . . . . 0.0 110.125 179.405 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 53.2 p -71.48 161.62 30.74 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 -176.594 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -58.44 -15.49 11.09 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 115.372 1.619 . . . . 0.0 115.372 177.399 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -70.56 136.6 85.96 Favored Pre-proline 0 CA--C 1.552 1.027 0 C-N-CA 125.047 1.339 . . . . 0.0 112.244 -178.359 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_exo -57.07 -27.89 76.12 Favored 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 123.426 2.751 . . . . 0.0 114.066 172.631 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 14.5 tppt? -84.4 1.73 43.94 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 125.395 1.478 . . . . 0.0 113.997 -177.916 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -67.11 161.41 24.64 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -172.959 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 28.0 mp0 -128.09 159.15 35.99 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.794 2.037 . . . . 0.0 108.983 170.72 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 42.4 mt -82.83 120.44 34.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 123.509 0.723 . . . . 0.0 110.597 178.868 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 15.3 ptpt -90.99 143.76 26.38 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.421 1.089 . . . . 0.0 111.241 168.648 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -140.07 158.79 43.5 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 126.255 1.822 . . . . 0.0 110.351 -173.222 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 6.2 t -136.74 -166.67 1.94 Allowed 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.269 1.028 . . . . 0.0 112.871 -179.985 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 96.4 mt -62.7 124.77 21.86 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.268 1.827 . . . . 0.0 112.423 -170.371 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 73.6 mtm-85 -62.23 151.36 36.45 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.817 1.647 . . . . 0.0 113.507 -173.965 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.89 166.26 12.17 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.668 1.987 . . . . 0.0 110.846 173.33 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -133.85 146.24 50.42 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.422 1.089 . . . . 0.0 111.996 178.727 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 59.5 tp -113.86 137.11 52.12 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 126.182 1.793 . . . . 0.0 110.201 173.051 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 61.9 ttm-85 -127.81 120.18 27.28 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 125.522 1.529 . . . . 0.0 109.699 169.412 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 43.5 t -104.32 113.35 41.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 124.786 1.234 . . . . 0.0 108.742 173.144 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 53.8 p -95.05 140.88 29.38 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.349 1.459 . . . . 0.0 110.039 -178.697 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 4.2 pm0 -61.96 144.32 55.24 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.729 0.812 . . . . 0.0 112.855 -172.406 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 45.3 ttt85 . . . . . 0 N--CA 1.468 0.437 0 C-N-CA 124.049 0.939 . . . . 0.0 110.837 -170.399 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 86.7 m . . . . . 0 N--CA 1.472 0.648 0 CA-C-O 121.438 0.637 . . . . 0.0 110.944 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -114.11 124.32 51.8 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.97 2.108 . . . . 0.0 108.11 169.318 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 88.0 p -140.75 156.09 69.05 Favored Pre-proline 0 CA--C 1.549 0.916 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -169.156 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -66.68 161.18 75.84 Favored 'Cis proline' 0 C--N 1.355 0.894 0 CA-C-N 119.84 0.979 . . . . 0.0 112.111 -2.457 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.81 -27.5 66.65 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 177.75 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 49.1 tp -141.15 122.54 14.93 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.365 1.466 . . . . 0.0 108.749 169.835 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 59.5 tp -106.16 126.06 51.75 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.157 1.383 . . . . 0.0 109.057 170.869 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.3 t -109.68 124.43 66.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 123.864 0.866 . . . . 0.0 108.798 172.998 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 33.7 m -128.66 172.43 15.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 C-N-CA 124.919 1.287 . . . . 0.0 110.951 171.43 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 66.2 m -104.48 151.92 22.98 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.516 1.526 . . . . 0.0 110.313 170.971 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -44.29 124.63 4.12 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.313 1.445 . . . . 0.0 112.967 172.357 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 89.99 -2.37 81.68 Favored Glycine 0 CA--C 1.531 1.048 0 C-N-CA 125.732 1.634 . . . . 0.0 114.484 -179.261 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -89.31 153.82 20.58 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.699 1.75 . . . . 0.0 111.909 174.367 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -80.81 118.25 22.17 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.588 0.755 . . . . 0.0 110.355 174.806 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -97.32 114.26 26.02 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.074 0.95 . . . . 0.0 110.533 178.978 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 46.9 m -122.35 124.19 43.13 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.936 0.895 . . . . 0.0 111.4 -175.288 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -102.45 158.16 16.41 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 126.646 1.978 . . . . 0.0 110.742 171.683 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 86.1 m -101.63 135.05 43.8 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.13 1.372 . . . . 0.0 109.551 169.861 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 42.7 t -113.7 132.79 55.67 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.611 1.564 . . . . 0.0 110.691 169.631 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 67.3 m -126.55 122.13 34.24 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.948 0.899 . . . . 0.0 110.852 179.574 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 24.8 m-85 . . . . . 0 N--CA 1.47 0.528 0 C-N-CA 126.701 2.0 . . . . 0.0 110.682 169.515 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 52.1 p90 . . . . . 0 CA--C 1.54 0.566 0 CA-C-O 120.481 0.181 . . . . 0.0 110.774 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 58.2 t -95.94 129.35 46.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 C-N-CA 124.503 1.121 . . . . 0.0 108.24 175.29 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 19.4 tp -107.59 139.72 41.7 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.417 1.087 . . . . 0.0 109.923 172.592 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 13.6 m-80 -132.78 149.84 52.23 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.524 1.529 . . . . 0.0 111.107 -168.997 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 18.3 t90 -121.73 137.89 54.58 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.035 1.334 . . . . 0.0 111.617 -179.055 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -137.43 145.33 43.03 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 -172.836 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -102.03 139.76 37.22 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.021 1.328 . . . . 0.0 108.274 167.01 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 32.8 mtp -84.26 142.75 30.02 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.107 0.867 . . . . 0.0 112.11 176.862 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 45.6 m -91.17 158.4 41.41 Favored Pre-proline 0 CA--C 1.548 0.883 0 C-N-CA 124.843 1.257 . . . . 0.0 111.68 174.867 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -55.43 -33.45 85.89 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 123.947 3.098 . . . . 0.0 114.346 177.245 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.3 m -76.99 6.31 6.52 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.904 1.282 . . . . 0.0 113.895 177.374 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 74.02 20.93 2.69 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 127.208 2.203 . . . . 0.0 112.895 -178.188 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 20.7 mm100 -88.63 -172.89 3.92 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.185 0.994 . . . . 0.0 110.258 169.658 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.6 p -145.48 142.69 29.47 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.663 1.585 . . . . 0.0 110.323 -174.805 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -119.93 130.55 54.85 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 124.578 1.151 . . . . 0.0 111.17 175.493 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -77.97 125.75 29.81 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.364 1.065 . . . . 0.0 111.089 -177.12 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 55.7 mt -99.81 -49.31 4.4 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 125.172 1.389 . . . . 0.0 111.278 -172.658 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -162.6 173.16 14.3 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.249 1.819 . . . . 0.0 110.479 -178.006 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.18 163.34 36.11 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.074 1.35 . . . . 0.0 111.733 -178.215 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -145.62 124.08 6.52 Favored Pre-proline 0 CA--C 1.546 0.825 0 C-N-CA 124.833 1.253 . . . . 0.0 110.676 172.229 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo . . . . . 0 CA--C 1.538 0.681 0 CA-C-N 119.48 0.85 . . . . 0.0 112.761 -12.949 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 41.6 mmm-85 . . . . . 0 CA--C 1.536 0.433 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 -108.05 135.3 49.64 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.789 1.236 . . . . 0.0 111.046 177.82 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 49.7 ttp180 -138.11 136.95 37.23 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.679 1.591 . . . . 0.0 110.609 -176.242 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 87.3 t -126.43 130.25 71.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 C-N-CA 125.633 1.573 . . . . 0.0 109.157 175.579 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 87.1 m -130.58 130.34 43.92 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.117 1.367 . . . . 0.0 110.281 -176.363 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -82.87 133.97 35.11 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.16 0.984 . . . . 0.0 110.195 173.652 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 28.4 mt -86.63 160.33 50.67 Favored Pre-proline 0 CA--C 1.543 0.697 0 C-N-CA 123.587 0.755 . . . . 0.0 111.339 176.659 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -62.49 -8.23 12.44 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 123.374 2.716 . . . . 0.0 114.187 174.75 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -65.77 -22.34 66.57 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-N 119.207 0.912 . . . . 0.0 112.602 169.271 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 80.66 -34.33 2.3 Favored Glycine 0 N--CA 1.473 1.167 0 C-N-CA 128.232 2.825 . . . . 0.0 113.914 175.871 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? -122.62 73.64 1.14 Allowed 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.743 1.617 . . . . 0.0 108.663 168.191 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -177.64 140.82 0.27 Allowed 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 128.495 2.718 . . . . 0.0 108.432 176.651 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -143.64 153.26 42.33 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 -168.666 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 21.4 m170 -108.67 131.72 54.63 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.341 1.456 . . . . 0.0 110.845 168.556 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -113.95 120.25 40.03 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 126.612 1.965 . . . . 0.0 108.157 176.691 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.2 t -128.31 127.17 42.22 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -168.383 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 47.8 t -91.17 116.39 32.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 125.441 1.496 . . . . 0.0 107.08 169.117 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 61.0 t -83.96 120.26 34.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 124.637 1.175 . . . . 0.0 109.638 -175.784 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 52.15 65.73 1.42 Allowed 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.228 1.811 . . . . 0.0 111.567 179.167 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.66 147.59 51.65 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.717 1.207 . . . . 0.0 112.628 -171.507 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 54.7 mmm-85 -122.72 165.31 16.75 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.971 1.709 . . . . 0.0 110.578 178.475 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 34.9 mtp180 -55.11 -33.88 63.21 Favored 'General case' 0 N--CA 1.483 1.217 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 -173.15 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -62.12 -18.54 61.13 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 125.241 1.417 . . . . 0.0 114.637 175.28 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 -81.21 -12.65 59.11 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 119.582 1.083 . . . . 0.0 113.316 176.903 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 20.9 m -62.64 138.63 58.54 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 119.517 1.053 . . . . 0.0 112.438 -179.486 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 154.74 -166.93 32.53 Favored Glycine 0 N--CA 1.473 1.124 0 O-C-N 121.377 -0.827 . . . . 0.0 113.611 -177.033 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 6.4 m -93.9 144.35 25.52 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.334 1.054 . . . . 0.0 110.366 -178.844 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 68.9 m-85 -142.96 155.51 44.7 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.354 1.461 . . . . 0.0 111.681 -177.989 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.4 pp -153.5 173.43 15.71 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.37 1.068 . . . . 0.0 112.593 177.933 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 28.1 t -125.6 156.13 39.63 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.813 1.645 . . . . 0.0 110.316 -176.209 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -152.74 137.02 5.64 Favored Glycine 0 N--CA 1.47 0.931 0 O-C-N 121.197 -0.939 . . . . 0.0 114.677 -179.188 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -110.02 152.1 26.34 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.736 1.214 . . . . 0.0 112.721 -179.506 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.5 tt -152.13 135.44 7.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 125.55 1.54 . . . . 0.0 110.442 173.634 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 33.7 m -67.04 159.65 28.26 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.775 0.83 . . . . 0.0 112.91 179.452 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 2.3 pp -72.05 -7.93 51.68 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 115.406 1.632 . . . . 0.0 115.406 -176.861 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -80.8 148.59 65.46 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 124.71 1.204 . . . . 0.0 112.082 177.156 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -68.66 -19.79 41.37 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 123.245 2.63 . . . . 0.0 113.355 -179.924 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -77.37 -9.56 58.92 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.798 1.239 . . . . 0.0 113.665 177.12 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.86 162.85 20.77 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.004 1.322 . . . . 0.0 113.785 -175.765 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -138.21 154.72 49.1 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.011 1.724 . . . . 0.0 109.368 175.857 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 45.8 mt -79.27 126.66 39.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 123.345 0.658 . . . . 0.0 110.838 -175.687 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -102.6 129.09 49.06 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.223 1.409 . . . . 0.0 109.38 169.375 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -104.11 149.42 25.24 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.742 1.217 . . . . 0.0 111.842 -174.386 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 88.1 p -91.62 170.03 10.26 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.661 1.356 . . . . 0.0 114.661 178.81 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 87.8 mt -68.27 127.77 34.13 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.033 0.933 . . . . 0.0 109.471 168.809 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.1 166.88 20.47 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 115.236 1.569 . . . . 0.0 115.236 -169.602 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -126.35 168.78 13.69 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.842 2.057 . . . . 0.0 111.234 169.574 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -120.57 142.16 49.62 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.301 1.44 . . . . 0.0 110.89 173.007 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 51.4 tp -110.16 131.24 55.23 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 126.082 1.753 . . . . 0.0 109.791 171.852 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -121.78 117.66 27.11 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.674 1.59 . . . . 0.0 109.395 169.955 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 39.5 t -104.18 111.84 35.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 C-N-CA 124.225 1.01 . . . . 0.0 108.665 170.949 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 71.8 p -86.69 151.3 23.53 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 126.087 1.755 . . . . 0.0 110.28 179.564 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -63.09 149.29 45.52 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.811 0.844 . . . . 0.0 112.805 -175.142 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 56.8 ttp180 . . . . . 0 C--O 1.236 0.366 0 C-N-CA 124.517 1.127 . . . . 0.0 109.697 -174.21 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 37.3 p . . . . . 0 N--CA 1.479 0.975 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -121.93 134.39 54.84 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.382 1.473 . . . . 0.0 109.912 173.936 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.9 m -140.85 156.39 68.73 Favored Pre-proline 0 N--CA 1.479 1.016 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 179.523 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -70.17 158.16 92.51 Favored 'Cis proline' 0 C--N 1.352 0.733 0 CA-C-N 119.494 0.855 . . . . 0.0 110.926 -8.646 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -56.96 -32.01 65.6 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 172.715 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 49.2 tp -139.13 121.17 15.66 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.351 1.46 . . . . 0.0 109.322 170.031 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 49.4 tp -102.19 126.93 49.3 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.351 1.46 . . . . 0.0 109.205 171.019 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.6 t -110.75 124.64 67.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 124.081 0.952 . . . . 0.0 108.454 172.011 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 36.0 m -127.52 168.83 19.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 124.618 1.167 . . . . 0.0 111.677 174.174 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 44.0 m -94.54 146.41 24.12 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.869 1.267 . . . . 0.0 110.151 170.915 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -57.13 117.65 4.24 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.474 1.51 . . . . 0.0 111.867 -178.973 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 100.26 -2.9 56.53 Favored Glycine 0 CA--C 1.534 1.268 0 C-N-CA 125.919 1.723 . . . . 0.0 114.58 -175.937 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -86.21 157.27 20.01 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.232 1.516 . . . . 0.0 112.286 173.988 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -83.25 113.48 20.71 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.006 0.923 . . . . 0.0 110.44 175.773 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -95.82 116.63 29.19 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.101 0.961 . . . . 0.0 110.837 -178.754 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 36.1 m -121.5 127.49 51.09 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.763 0.825 . . . . 0.0 111.558 -177.014 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -100.66 150.42 22.75 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.07 1.748 . . . . 0.0 110.896 170.625 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 27.3 m -93.15 137.88 32.08 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 125.917 1.687 . . . . 0.0 108.179 169.337 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 42.9 t -143.88 131.19 20.85 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.9 1.28 . . . . 0.0 110.37 -176.356 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.9 t -128.27 136.09 50.54 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 121.321 -0.862 . . . . 0.0 112.058 -169.663 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 . . . . . 0 CA--C 1.535 0.382 0 C-N-CA 125.786 1.634 . . . . 0.0 113.464 174.504 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 54.4 p90 . . . . . 0 CA--C 1.538 0.499 0 CA-C-O 120.947 0.403 . . . . 0.0 111.787 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.4 t -95.95 129.39 46.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 125.204 1.402 . . . . 0.0 107.275 172.927 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 57.8 tp -99.39 134.72 41.85 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 124.167 0.987 . . . . 0.0 109.528 173.984 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 -127.84 155.39 44.2 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.107 1.363 . . . . 0.0 110.641 -177.922 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 10.1 t90 -125.36 137.3 54.03 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.634 1.174 . . . . 0.0 111.628 178.868 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -132.81 150.93 52.11 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.228 1.411 . . . . 0.0 113.347 -176.392 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -112.73 141.5 46.45 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.794 1.638 . . . . 0.0 109.178 168.992 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 81.2 mmm -74.19 133.39 42.73 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.057 0.543 . . . . 0.0 111.34 173.755 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 50.0 m -86.04 157.52 56.85 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 124.65 1.18 . . . . 0.0 111.783 172.807 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -57.57 -28.25 80.34 Favored 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 123.905 3.07 . . . . 0.0 114.284 174.97 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 25.2 p -77.03 3.81 11.51 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 126.022 1.729 . . . . 0.0 114.033 174.868 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 67.53 20.96 9.65 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 127.308 2.243 . . . . 0.0 112.932 -174.021 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -90.13 -172.65 3.56 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.958 1.303 . . . . 0.0 109.925 169.045 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.0 p -138.98 145.65 39.97 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.025 1.33 . . . . 0.0 110.347 -177.717 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -122.67 134.56 54.48 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 123.775 0.83 . . . . 0.0 111.569 173.154 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -75.23 137.52 41.3 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.96 0.904 . . . . 0.0 111.174 179.406 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 52.0 mt -114.55 -39.78 3.73 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.384 1.474 . . . . 0.0 112.865 -169.916 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -171.7 175.29 4.03 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.619 1.968 . . . . 0.0 110.175 -176.126 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -157.06 167.72 29.61 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.936 1.294 . . . . 0.0 112.096 179.844 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -145.23 115.44 4.99 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 125.76 1.624 . . . . 0.0 109.378 169.345 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_exo . . . . . 0 C--N 1.352 0.713 0 CA-C-N 120.22 1.114 . . . . 0.0 113.546 -5.573 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 30.4 ptt-85 . . . . . 0 CA--C 1.536 0.425 0 N-CA-C 113.893 1.072 . . . . 0.0 113.893 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 84.6 m-85 -93.83 123.41 37.16 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.488 1.115 . . . . 0.0 110.013 176.078 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -139.02 144.68 38.98 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.146 0.978 . . . . 0.0 111.645 -175.267 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 57.5 t -126.55 126.73 69.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 125.36 1.464 . . . . 0.0 109.379 -179.428 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 86.4 m -130.53 137.75 49.87 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.876 1.271 . . . . 0.0 110.421 -176.109 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -82.17 141.93 32.63 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.358 0.599 . . . . 0.0 112.459 172.249 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 39.2 mt -77.9 161.05 72.67 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 123.419 0.687 . . . . 0.0 110.898 169.37 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -68.37 -4.16 12.32 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 123.435 2.757 . . . . 0.0 113.562 171.699 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.81 -23.05 65.98 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 124.33 1.052 . . . . 0.0 112.494 172.005 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 93.66 -18.43 56.52 Favored Glycine 0 N--CA 1.477 1.428 0 C-N-CA 125.646 1.593 . . . . 0.0 114.715 170.695 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 27.1 ptt180 -154.59 73.66 0.91 Allowed 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 126.085 1.754 . . . . 0.0 109.204 170.08 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -173.8 147.53 1.36 Allowed 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 128.308 2.643 . . . . 0.0 108.462 -178.461 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 25.0 m-85 -146.86 157.08 43.56 Favored 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 113.958 1.096 . . . . 0.0 113.958 -166.383 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -116.55 143.09 46.04 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.193 1.797 . . . . 0.0 110.744 169.014 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 39.8 mtt -126.85 120.64 29.74 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.975 1.31 . . . . 0.0 109.95 177.615 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 69.0 m -120.42 128.21 52.98 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 114.263 1.208 . . . . 0.0 114.263 -168.041 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 21.6 t -94.6 98.88 8.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 N-CA-C 105.958 -1.868 . . . . 0.0 105.958 167.017 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 92.8 t -70.5 125.43 28.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.597 1.159 . . . . 0.0 109.182 -179.035 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 75.8 ttt180 52.35 65.59 1.46 Allowed 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.21 1.404 . . . . 0.0 110.929 179.181 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.26 130.57 43.29 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 121.327 -0.858 . . . . 0.0 111.721 -172.281 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 8.1 mpt_? -95.3 161.83 13.93 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.594 1.558 . . . . 0.0 110.086 175.266 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 89.8 mtm-85 -53.4 -36.92 61.98 Favored 'General case' 0 N--CA 1.482 1.141 0 O-C-N 121.151 -0.968 . . . . 0.0 112.708 179.732 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -62.35 -16.03 51.94 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.045 1.738 . . . . 0.0 114.845 176.264 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -80.53 -11.16 59.7 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 119.958 1.254 . . . . 0.0 113.272 176.234 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 21.2 m -63.91 132.23 50.12 Favored 'General case' 0 N--CA 1.477 0.878 0 O-C-N 120.534 -1.354 . . . . 0.0 112.586 -179.803 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 158.96 -167.32 34.79 Favored Glycine 0 N--CA 1.472 1.042 0 O-C-N 121.162 -0.961 . . . . 0.0 113.725 -177.68 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.2 m -93.4 138.31 31.86 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.888 1.275 . . . . 0.0 110.721 -178.045 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -135.9 156.46 48.73 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.804 1.641 . . . . 0.0 112.556 -177.647 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -160.25 148.62 16.82 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.808 1.243 . . . . 0.0 112.332 179.184 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 4.5 m -89.13 170.49 10.57 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.293 0.568 . . . . 0.0 111.999 172.49 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -155.04 115.6 0.67 Allowed Glycine 0 CA--C 1.526 0.765 0 C-N-CA 124.532 1.063 . . . . 0.0 111.673 168.435 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -87.82 156.26 19.48 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 117.791 0.795 . . . . 0.0 111.638 172.458 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 17.8 tt -154.43 130.19 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 124.602 1.161 . . . . 0.0 110.791 174.297 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 22.8 m -67.92 159.28 30.85 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.648 1.179 . . . . 0.0 113.402 -178.25 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.81 -9.91 48.34 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 115.578 1.696 . . . . 0.0 115.578 179.012 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -75.05 142.93 76.65 Favored Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 124.335 1.054 . . . . 0.0 112.265 -179.142 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_exo -56.14 -27.75 66.96 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 123.607 2.871 . . . . 0.0 114.658 174.736 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -84.51 0.98 47.78 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.819 1.248 . . . . 0.0 114.309 -179.49 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.88 164.52 17.26 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 124.4 1.08 . . . . 0.0 113.683 -177.213 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -146.1 152.44 39.31 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.76 1.624 . . . . 0.0 109.424 178.681 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 64.9 mt -71.46 123.37 25.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 124.28 1.032 . . . . 0.0 111.023 -174.774 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -83.72 88.38 7.07 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.451 1.501 . . . . 0.0 110.742 178.268 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -74.86 152.86 38.88 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.882 0.873 . . . . 0.0 110.566 171.353 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 58.8 m -157.35 -177.39 6.56 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.104 1.362 . . . . 0.0 112.24 179.528 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.5 tt -55.65 106.96 0.29 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.316 1.846 . . . . 0.0 113.083 -170.627 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.33 156.52 15.54 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.8 1.64 . . . . 0.0 114.762 -175.538 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -118.77 169.65 9.66 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 126.865 2.066 . . . . 0.0 111.558 177.559 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -130.82 144.94 51.81 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.844 1.257 . . . . 0.0 111.821 179.605 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 55.1 tp -115.21 134.8 54.81 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 126.417 1.887 . . . . 0.0 110.178 173.771 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 60.0 ttt85 -125.9 120.62 30.89 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.791 1.636 . . . . 0.0 109.755 171.207 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 46.6 t -106.43 114.71 46.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 124.833 1.253 . . . . 0.0 108.763 174.9 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 70.3 p -98.64 146.04 26.25 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.948 1.699 . . . . 0.0 110.416 -177.972 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 -59.05 146.98 36.48 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -172.355 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 20.0 ttp-105 . . . . . 0 C--O 1.236 0.345 0 C-N-CA 124.594 1.158 . . . . 0.0 108.803 -176.036 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.2 t . . . . . 0 N--CA 1.474 0.754 0 N-CA-C 112.016 0.376 . . . . 0.0 112.016 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -129.45 132.92 47.07 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.002 1.721 . . . . 0.0 110.761 -171.05 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 92.8 p -140.86 154.99 69.22 Favored Pre-proline 0 CA--C 1.55 0.98 0 N-CA-C 113.893 1.071 . . . . 0.0 113.893 -172.283 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -66.98 160.07 79.03 Favored 'Cis proline' 0 C--N 1.353 0.804 0 CA-C-N 119.409 0.825 . . . . 0.0 111.497 -6.405 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.86 -28.68 66.33 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 176.521 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 47.8 tp -141.13 122.59 15.01 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.586 1.554 . . . . 0.0 109.049 170.252 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 54.6 tp -105.84 126.11 51.79 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.033 1.333 . . . . 0.0 109.32 170.926 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.4 t -109.08 123.77 65.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 124.028 0.931 . . . . 0.0 108.915 173.164 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.3 m -127.93 170.05 18.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 125.047 1.339 . . . . 0.0 111.474 172.86 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 18.4 m -98.16 151.74 20.1 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.472 1.509 . . . . 0.0 110.39 173.856 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -47.92 127.48 12.11 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.568 1.147 . . . . 0.0 111.45 168.777 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 86.24 -1.05 87.55 Favored Glycine 0 CA--C 1.532 1.137 0 C-N-CA 125.306 1.431 . . . . 0.0 114.664 -178.044 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.5 t0 -89.14 160.3 17.07 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.664 1.732 . . . . 0.0 111.912 173.786 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 71.4 m-20 -93.68 118.71 31.75 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.418 1.087 . . . . 0.0 110.191 175.343 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -97.88 120.44 38.28 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.875 1.27 . . . . 0.0 110.791 -179.992 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 23.1 m -125.38 125.82 44.03 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.593 0.757 . . . . 0.0 111.049 178.99 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -102.31 159.36 15.48 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.2 1.8 . . . . 0.0 111.034 172.078 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 71.3 m -113.4 126.82 55.77 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.722 1.609 . . . . 0.0 109.375 175.848 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -118.3 127.62 53.88 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.91 1.284 . . . . 0.0 111.525 179.012 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 57.6 m -118.91 139.36 51.77 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.983 1.313 . . . . 0.0 109.877 -172.278 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 38.1 m-85 . . . . . 0 CA--C 1.536 0.42 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -169.651 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 30.8 p90 . . . . . 0 CA--C 1.538 0.514 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 57.6 t -95.99 132.59 39.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 125.482 1.513 . . . . 0.0 107.038 167.465 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.31 113.48 25.81 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.849 0.86 . . . . 0.0 109.256 176.31 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 35.0 m120 -106.19 145.97 30.86 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.153 1.381 . . . . 0.0 111.177 179.91 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 18.5 t90 -114.83 136.36 53.18 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.669 1.188 . . . . 0.0 111.018 176.511 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -130.1 145.18 51.67 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.83 1.252 . . . . 0.0 113.998 -173.012 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 52.3 ttp85 -101.12 144.45 29.99 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 126.409 1.884 . . . . 0.0 107.64 167.017 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 33.5 mtp -90.26 145.79 24.73 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 118.948 0.794 . . . . 0.0 112.212 173.507 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 41.2 m -111.45 149.88 41.29 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 125.649 1.58 . . . . 0.0 111.071 173.805 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -69.32 -14.54 37.66 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 124.333 3.356 . . . . 0.0 114.164 -170.424 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.2 m -76.79 10.39 2.26 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.687 1.195 . . . . 0.0 112.929 171.162 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 68.15 48.82 0.9 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 127.434 2.294 . . . . 0.0 111.021 -176.565 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 26.9 mm-40 -130.72 175.71 8.8 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.441 1.496 . . . . 0.0 110.736 -178.523 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.0 p -136.13 150.99 49.32 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.938 1.695 . . . . 0.0 111.107 -177.354 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 39.6 t0 -133.99 127.72 32.93 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.573 1.549 . . . . 0.0 110.745 -177.798 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 30.6 ttmt -74.23 129.05 37.08 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.689 0.796 . . . . 0.0 110.734 -178.917 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 78.4 mt -101.35 -49.09 4.16 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 125.159 1.384 . . . . 0.0 112.294 -175.147 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -165.78 176.74 7.71 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 127.044 2.137 . . . . 0.0 109.409 -178.853 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -157.44 167.22 30.84 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.767 0.827 . . . . 0.0 113.003 -176.87 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -139.52 117.0 8.56 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 125.557 1.543 . . . . 0.0 109.4 169.405 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo . . . . . 0 C--N 1.352 0.73 0 CA-C-N 120.502 1.215 . . . . 0.0 113.656 -6.302 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 12.5 mmt85 . . . . . 0 N--CA 1.474 0.759 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -111.91 136.3 51.4 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.064 1.746 . . . . 0.0 110.081 174.311 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 12.1 mtm180 -144.52 149.26 35.61 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.7 1.2 . . . . 0.0 112.715 179.108 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 43.9 t -126.5 131.19 71.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 C-N-CA 125.69 1.596 . . . . 0.0 109.652 175.713 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 89.1 m -130.5 136.45 48.98 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.728 1.211 . . . . 0.0 110.407 178.269 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -80.28 141.89 35.08 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 118.566 0.621 . . . . 0.0 112.081 174.759 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 19.6 mt -85.48 158.62 57.15 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 123.751 0.82 . . . . 0.0 111.271 169.75 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -66.15 -4.55 10.58 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 123.656 2.904 . . . . 0.0 114.201 174.306 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -61.13 -26.15 67.48 Favored 'General case' 0 CA--C 1.551 1.007 0 CA-C-N 119.49 1.041 . . . . 0.0 112.835 169.699 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 98.73 -34.07 5.6 Favored Glycine 0 CA--C 1.531 1.078 0 C-N-CA 126.113 1.816 . . . . 0.0 114.224 172.708 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 57.1 mtm180 -135.36 73.59 1.48 Allowed 'General case' 0 N--CA 1.475 0.785 0 CA-C-O 122.616 1.198 . . . . 0.0 109.589 169.314 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -168.19 143.9 3.75 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 127.337 2.255 . . . . 0.0 108.651 -179.735 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -145.76 148.21 32.73 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.736 0.815 . . . . 0.0 112.833 -167.691 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -104.66 129.17 52.86 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.076 1.351 . . . . 0.0 110.673 168.827 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.4 mpt? -113.21 114.02 26.16 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 126.252 1.821 . . . . 0.0 108.987 -178.924 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 34.7 t -118.91 126.82 52.66 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.768 1.025 . . . . 0.0 113.768 -169.348 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 22.8 t -101.0 113.04 35.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 167.838 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 3.6 m -89.29 139.28 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-N 118.506 0.594 . . . . 0.0 111.864 179.424 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 19.9 tpt180 56.07 51.37 12.03 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.129 1.772 . . . . 0.0 111.712 173.658 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.12 158.96 24.49 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 114.589 1.329 . . . . 0.0 114.589 -168.81 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 4.8 ptm180 -135.77 151.83 50.5 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 127.816 2.446 . . . . 0.0 109.605 -172.159 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 36.1 mtp180 -53.35 -37.55 62.48 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 114.387 1.254 . . . . 0.0 114.387 -169.628 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -65.43 -13.79 59.49 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 125.053 1.341 . . . . 0.0 114.546 177.217 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -72.49 -16.69 61.79 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.978 1.263 . . . . 0.0 112.689 172.96 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.6 m -62.05 132.8 54.08 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.073 -1.017 . . . . 0.0 112.505 -177.388 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 159.76 -167.09 35.19 Favored Glycine 0 N--CA 1.473 1.112 0 C-N-CA 124.227 0.918 . . . . 0.0 114.031 -174.654 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.9 m -94.46 144.46 25.54 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.274 1.43 . . . . 0.0 110.977 -178.032 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -144.65 155.08 43.42 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.588 1.555 . . . . 0.0 111.789 -175.375 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -160.65 161.58 32.45 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.94 1.296 . . . . 0.0 113.441 179.511 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 3.5 m -104.67 162.74 13.02 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.342 1.457 . . . . 0.0 111.449 179.057 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -153.19 134.52 4.46 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 123.89 0.757 . . . . 0.0 113.369 169.883 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -99.27 126.78 45.17 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.981 0.913 . . . . 0.0 110.777 173.64 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 16.7 tt -122.28 131.36 73.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 O-C-N 121.266 -0.896 . . . . 0.0 110.857 174.888 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.2 m -61.22 157.96 15.11 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.515 1.126 . . . . 0.0 113.151 -177.92 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 39.0 mt -73.15 -14.23 61.33 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 -178.752 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -69.55 154.3 94.95 Favored Pre-proline 0 CA--C 1.552 1.055 0 C-N-CA 125.061 1.344 . . . . 0.0 112.821 176.097 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.87 -24.69 24.29 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 123.011 2.474 . . . . 0.0 112.975 176.958 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 17.2 ttpp -89.09 13.36 13.25 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 125.248 1.419 . . . . 0.0 113.461 -179.433 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.78 168.08 10.21 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.564 1.546 . . . . 0.0 114.754 -173.64 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -142.97 147.67 35.57 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.209 1.804 . . . . 0.0 109.219 177.372 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 42.8 mt -80.83 125.1 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 123.995 0.918 . . . . 0.0 111.006 -175.04 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 32.2 mmtm -88.05 93.92 9.64 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.955 1.302 . . . . 0.0 107.983 169.361 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -79.24 139.64 37.86 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.621 0.769 . . . . 0.0 112.021 -174.178 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 69.4 m -84.5 156.06 21.88 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.395 1.078 . . . . 0.0 113.33 175.073 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 89.0 mt -62.2 135.75 57.63 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 168.44 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.82 165.14 25.46 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 115.428 1.64 . . . . 0.0 115.428 -169.679 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -129.59 169.53 14.91 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 127.07 2.148 . . . . 0.0 110.55 169.548 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -122.46 142.33 50.67 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.818 1.247 . . . . 0.0 111.477 176.651 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 60.7 tp -110.34 136.27 49.77 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 125.946 1.698 . . . . 0.0 109.91 172.012 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 68.2 ttt180 -127.61 121.66 31.1 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.682 1.593 . . . . 0.0 109.756 170.07 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 45.2 t -108.0 111.85 37.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 C-N-CA 124.977 1.311 . . . . 0.0 108.641 172.755 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 75.4 p -90.8 155.2 18.96 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 125.945 1.698 . . . . 0.0 110.694 -179.647 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -65.21 148.9 50.86 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.946 0.898 . . . . 0.0 113.385 -172.463 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 34.2 ttp-105 . . . . . 0 C--O 1.236 0.362 0 C-N-CA 124.602 1.161 . . . . 0.0 109.828 -175.405 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.8 t . . . . . 0 N--CA 1.466 0.374 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -121.24 144.02 48.83 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.418 1.087 . . . . 0.0 112.301 -168.459 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 79.9 p -140.91 153.88 67.92 Favored Pre-proline 0 CA--C 1.547 0.85 0 N-CA-C 113.728 1.011 . . . . 0.0 113.728 168.732 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -70.43 159.92 90.9 Favored 'Cis proline' 0 C--N 1.352 0.738 0 CA-C-N 118.96 0.664 . . . . 0.0 111.092 -10.066 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.57 -30.44 69.79 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 173.05 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 48.0 tp -138.52 120.26 15.25 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.52 1.528 . . . . 0.0 109.005 170.103 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 41.8 tp -102.01 127.16 49.0 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.132 1.373 . . . . 0.0 109.403 172.781 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.8 t -112.43 123.1 67.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 124.022 0.929 . . . . 0.0 108.925 173.57 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.5 m -128.5 166.38 25.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 C-N-CA 124.687 1.195 . . . . 0.0 112.195 173.55 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.0 m -88.51 150.11 23.28 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.938 1.295 . . . . 0.0 110.522 172.339 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -51.73 124.95 13.6 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.587 1.155 . . . . 0.0 111.639 173.684 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 86.25 -0.87 87.48 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 124.849 1.214 . . . . 0.0 114.593 -178.412 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -85.62 158.92 19.97 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 119.598 1.699 . . . . 0.0 111.52 171.428 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 8.0 p30 -86.02 130.05 34.65 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.506 0.722 . . . . 0.0 111.276 172.145 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -111.07 119.58 39.5 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.325 1.45 . . . . 0.0 110.76 -178.161 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 34.4 m -120.55 125.57 48.15 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.985 0.914 . . . . 0.0 111.675 -176.482 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -99.99 153.12 19.45 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.739 1.615 . . . . 0.0 110.406 169.126 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 37.2 m -103.8 131.35 51.07 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.27 1.428 . . . . 0.0 108.858 171.583 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 46.4 t -121.29 124.21 44.06 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.979 1.312 . . . . 0.0 111.082 171.521 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 24.0 t -125.26 146.3 49.61 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.161 1.385 . . . . 0.0 111.181 179.964 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 34.6 p90 . . . . . 0 N--CA 1.472 0.672 0 C-N-CA 125.07 1.348 . . . . 0.0 112.188 -170.042 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 5.0 p90 . . . . . 0 CA--C 1.539 0.521 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 48.0 t -109.61 137.85 39.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 126.286 1.834 . . . . 0.0 108.52 170.866 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 15.9 tp -102.94 130.79 50.12 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 123.641 0.776 . . . . 0.0 109.619 170.074 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -126.08 158.07 36.39 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.358 1.463 . . . . 0.0 111.568 -171.495 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 15.2 t90 -130.5 138.62 50.34 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.435 1.094 . . . . 0.0 112.149 -176.761 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -139.82 147.73 41.15 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.518 1.127 . . . . 0.0 113.436 -171.928 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 79.4 ttt-85 -110.93 138.29 47.51 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.542 1.537 . . . . 0.0 108.852 168.519 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 37.7 mtp -86.39 145.9 26.68 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 119.348 0.976 . . . . 0.0 112.492 177.046 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.1 p -86.01 163.0 44.98 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 123.824 0.849 . . . . 0.0 111.929 170.689 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -67.53 -19.45 48.59 Favored 'Trans proline' 0 C--N 1.354 0.85 0 C-N-CA 122.639 2.226 . . . . 0.0 112.575 171.574 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 21.9 m -82.41 12.54 4.38 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.135 1.374 . . . . 0.0 112.806 170.029 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . 0.312 0.4 OUTLIER 61.58 21.71 12.32 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 128.252 2.621 . . . . 0.0 115.574 179.185 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 17.7 mm100 -89.25 -172.68 3.73 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.072 0.949 . . . . 0.0 109.634 168.858 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.4 p -141.59 141.83 33.47 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.601 1.561 . . . . 0.0 110.318 -174.897 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -118.01 131.44 56.48 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 125.026 1.33 . . . . 0.0 110.369 175.582 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 55.4 tttm -83.07 119.42 24.46 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.554 1.141 . . . . 0.0 110.744 -174.285 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 74.6 mt -92.56 -49.45 6.1 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 124.731 1.213 . . . . 0.0 112.313 -169.206 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -172.55 175.32 3.53 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 127.005 2.122 . . . . 0.0 109.982 -173.206 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.61 172.15 18.32 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.992 1.317 . . . . 0.0 112.2 -178.686 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -143.5 118.42 6.24 Favored Pre-proline 0 CA--C 1.547 0.838 0 C-N-CA 124.809 1.244 . . . . 0.0 110.279 169.102 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo . . . . . 0 C--N 1.351 0.708 0 CA-C-N 119.154 0.733 . . . . 0.0 111.192 -10.183 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 84.4 mtt-85 . . . . . 0 N--CA 1.466 0.371 0 CA-C-O 118.72 -0.657 . . . . 0.0 112.647 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -91.7 116.35 28.81 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.454 1.101 . . . . 0.0 111.345 -169.65 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 -137.81 139.66 40.11 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.165 0.986 . . . . 0.0 111.029 -170.455 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 97.2 t -126.5 125.53 67.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 125.288 1.435 . . . . 0.0 109.487 -177.889 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 90.7 m -130.28 129.39 43.19 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.911 1.284 . . . . 0.0 110.935 -173.768 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -78.09 137.65 38.34 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.611 1.164 . . . . 0.0 111.188 178.291 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 51.0 mt -92.61 159.4 36.58 Favored Pre-proline 0 CA--C 1.545 0.772 0 C-N-CA 124.603 1.161 . . . . 0.0 111.823 177.437 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -64.96 -6.82 13.54 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 123.515 2.81 . . . . 0.0 113.993 173.573 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -68.43 -11.62 59.99 Favored 'General case' 0 CA--C 1.557 1.244 0 CA-C-N 119.336 0.971 . . . . 0.0 112.688 169.608 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 88.4 -34.16 3.91 Favored Glycine 0 N--CA 1.475 1.235 0 C-N-CA 126.964 2.221 . . . . 0.0 115.612 168.77 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 23.7 ptt-85 -140.5 73.61 1.43 Allowed 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 123.865 1.793 . . . . 0.0 109.925 172.008 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -169.54 137.83 1.84 Allowed 'General case' 0 C--O 1.237 0.446 0 C-N-CA 127.251 2.22 . . . . 0.0 107.195 -170.884 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 -143.86 137.97 28.3 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -167.642 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -92.28 126.07 37.2 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.432 1.093 . . . . 0.0 109.178 167.161 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 40.0 mtt -120.31 112.22 18.75 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 125.309 1.443 . . . . 0.0 108.793 -178.496 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 60.9 m -115.88 132.02 56.77 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 114.727 1.38 . . . . 0.0 114.727 -166.998 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 33.5 t -97.7 91.34 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 N-CA-C 105.777 -1.934 . . . . 0.0 105.777 166.743 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 86.0 t -73.54 121.48 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 123.764 0.825 . . . . 0.0 109.551 -178.971 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 59.39 73.88 0.46 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.007 1.723 . . . . 0.0 111.4 -175.675 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -79.97 147.86 31.41 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.372 1.469 . . . . 0.0 112.93 -175.91 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -116.48 162.75 17.1 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 126.904 2.082 . . . . 0.0 110.459 179.044 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 83.6 mtm-85 -56.18 -24.98 44.98 Favored 'General case' 0 N--CA 1.483 1.176 0 O-C-N 121.174 -0.954 . . . . 0.0 113.555 171.505 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -65.37 -25.36 67.54 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 124.816 1.246 . . . . 0.0 114.112 171.63 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -81.86 -26.69 34.01 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.924 0.89 . . . . 0.0 112.649 -179.622 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 45.4 m -48.78 133.0 17.89 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.337 1.055 . . . . 0.0 112.43 177.239 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 150.67 -162.0 29.19 Favored Glycine 0 N--CA 1.469 0.84 0 C-N-CA 123.839 0.733 . . . . 0.0 113.196 -172.784 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.9 m -96.1 140.86 30.21 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.289 1.436 . . . . 0.0 110.902 -172.706 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -134.13 156.22 48.68 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.642 1.577 . . . . 0.0 112.824 -177.159 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -155.17 156.19 35.26 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.264 1.426 . . . . 0.0 112.66 173.63 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -119.93 137.27 54.14 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.338 1.855 . . . . 0.0 109.847 176.144 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -141.74 132.44 5.25 Favored Glycine 0 N--CA 1.471 0.995 0 C-N-CA 124.086 0.851 . . . . 0.0 113.51 -171.556 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -88.52 156.18 19.23 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.025 0.93 . . . . 0.0 112.001 175.253 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 17.7 tt -154.08 133.7 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 124.889 1.276 . . . . 0.0 110.43 173.965 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 77.3 p -77.45 161.59 27.85 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.423 1.089 . . . . 0.0 113.135 178.427 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.82 -2.09 11.2 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 115.297 1.592 . . . . 0.0 115.297 178.479 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -73.03 145.74 86.56 Favored Pre-proline 0 CA--C 1.551 1.012 0 C-N-CA 124.287 1.035 . . . . 0.0 112.512 -177.101 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -56.53 -30.31 82.12 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 123.408 2.739 . . . . 0.0 113.949 172.794 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 59.7 mtpt -88.98 5.05 46.05 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.131 1.372 . . . . 0.0 114.059 -178.305 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.4 162.22 18.19 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.429 1.092 . . . . 0.0 113.848 -175.758 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -150.5 151.3 32.47 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.928 1.691 . . . . 0.0 109.185 -178.881 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 52.0 mt -68.93 122.57 20.57 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 123.685 0.794 . . . . 0.0 110.436 -177.512 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -80.83 88.4 5.84 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.91 1.284 . . . . 0.0 110.181 175.726 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -76.93 158.78 30.48 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.539 1.536 . . . . 0.0 112.879 -179.118 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 6.1 t -147.57 -170.22 3.51 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.821 0.848 . . . . 0.0 113.003 169.889 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 92.6 mt -68.93 127.77 34.29 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.984 1.714 . . . . 0.0 111.23 -177.488 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 10.7 mpt_? -68.51 159.64 31.39 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 126.236 1.814 . . . . 0.0 115.132 -168.851 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.91 169.68 9.05 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 127.256 2.222 . . . . 0.0 110.63 168.709 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -131.01 144.04 51.17 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.584 1.153 . . . . 0.0 112.334 -177.103 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 64.2 tp -112.93 137.62 51.04 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 126.374 1.87 . . . . 0.0 110.206 171.604 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 72.1 ttt180 -127.95 119.27 25.17 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.702 1.601 . . . . 0.0 109.851 169.812 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 41.5 t -100.89 118.68 47.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 124.673 1.189 . . . . 0.0 108.22 169.204 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 75.2 p -97.52 157.84 15.8 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.69 1.596 . . . . 0.0 110.785 178.955 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 56.7 mp0 -62.29 151.56 36.14 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.341 1.056 . . . . 0.0 112.332 -179.347 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 39.0 ttm105 . . . . . 0 C--O 1.236 0.365 0 C-N-CA 124.102 0.961 . . . . 0.0 110.332 -177.125 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.3 t . . . . . 0 N--CA 1.47 0.532 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 57.4 t80 -150.56 118.2 6.15 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 127.217 2.207 . . . . 0.0 109.405 -174.495 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 98.2 p -140.94 160.87 56.7 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 124.49 1.116 . . . . 0.0 113.704 -170.632 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -70.64 164.0 82.87 Favored 'Cis proline' 0 C--N 1.354 0.859 0 CA-C-N 119.91 1.003 . . . . 0.0 111.548 -6.561 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.44 -23.57 66.97 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 175.0 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 44.4 tp -142.2 122.82 14.2 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.617 1.567 . . . . 0.0 108.785 171.024 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 61.4 tp -110.68 125.83 53.88 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.086 1.354 . . . . 0.0 109.07 170.685 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 12.6 p -108.04 128.37 63.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 123.969 0.907 . . . . 0.0 109.775 169.826 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.7 m -128.78 168.22 22.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 125.096 1.359 . . . . 0.0 111.716 172.924 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 88.4 m -90.72 148.83 22.33 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.372 1.069 . . . . 0.0 110.37 171.581 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -57.14 117.03 3.63 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.989 1.716 . . . . 0.0 111.174 175.743 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.0 5.62 65.91 Favored Glycine 0 CA--C 1.532 1.136 0 C-N-CA 125.464 1.506 . . . . 0.0 114.694 -175.252 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -97.06 158.16 15.56 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 119.435 1.618 . . . . 0.0 112.324 173.22 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 29.4 m120 -72.81 131.83 42.79 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.73 1.212 . . . . 0.0 111.199 173.845 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -117.86 114.01 22.62 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.562 1.145 . . . . 0.0 111.186 178.757 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 32.8 m -124.72 125.33 43.91 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.536 0.734 . . . . 0.0 111.905 -174.273 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -101.46 158.13 16.3 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.513 1.925 . . . . 0.0 110.4 169.965 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 28.1 m -102.67 137.39 40.96 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.349 1.46 . . . . 0.0 109.597 172.684 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 39.1 t -130.28 142.76 50.53 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.068 1.347 . . . . 0.0 111.812 170.498 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.9 m -140.61 128.07 21.33 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.009 0.524 . . . . 0.0 112.285 -174.233 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 26.4 m-85 . . . . . 0 N--CA 1.472 0.653 0 C-N-CA 126.826 2.05 . . . . 0.0 113.412 175.764 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 35.1 p90 . . . . . 0 CA--C 1.54 0.584 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.3 t -95.98 125.08 48.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 N-CA-C 106.277 -1.749 . . . . 0.0 106.277 168.474 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 19.5 tp -101.94 134.84 44.5 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 123.569 0.748 . . . . 0.0 110.037 175.28 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 8.6 m-80 -132.03 145.79 51.66 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.832 1.253 . . . . 0.0 110.903 -169.773 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 11.5 t90 -111.43 140.65 45.84 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 124.596 1.158 . . . . 0.0 111.374 178.289 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -133.78 140.29 46.85 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 -175.668 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 68.3 ttt180 -96.58 140.0 31.84 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.268 1.027 . . . . 0.0 108.742 167.834 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 33.3 mtp -97.02 145.92 25.49 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -177.085 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.8 p -85.49 163.77 43.21 Favored Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 123.717 0.807 . . . . 0.0 111.355 169.258 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -67.76 -18.4 47.62 Favored 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 122.661 2.24 . . . . 0.0 112.763 172.781 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 32.7 m -83.34 1.55 40.67 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.635 1.174 . . . . 0.0 112.91 170.861 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 74.46 22.44 2.13 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 127.784 2.433 . . . . 0.0 113.759 179.424 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -83.34 177.07 8.66 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.213 0.605 . . . . 0.0 109.463 168.399 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 11.7 p -144.22 139.1 28.5 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.841 1.257 . . . . 0.0 111.098 -169.904 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -122.51 130.11 52.7 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.028 0.931 . . . . 0.0 111.5 174.679 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -73.01 126.94 31.13 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.372 0.669 . . . . 0.0 111.021 -179.258 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 43.4 mt -98.27 -46.37 5.84 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.739 1.615 . . . . 0.0 111.989 -173.698 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -167.83 167.79 12.76 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 127.167 2.187 . . . . 0.0 109.784 -174.04 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -156.75 160.2 39.05 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.392 1.077 . . . . 0.0 112.372 -176.212 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -133.76 130.67 20.79 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 124.861 1.264 . . . . 0.0 110.21 170.607 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo . . . . . 0 C--N 1.351 0.673 0 CA-C-N 119.932 1.012 . . . . 0.0 111.473 -3.928 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 12.4 mtp85 . . . . . 0 N--CA 1.466 0.339 0 N-CA-C 115.344 1.609 . . . . 0.0 115.344 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -118.3 140.47 49.78 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.137 1.775 . . . . 0.0 111.318 -174.156 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 31.4 ttp-105 -140.11 144.1 36.59 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.163 1.385 . . . . 0.0 111.465 -174.493 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 46.3 t -121.87 127.87 75.53 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 C-N-CA 124.887 1.275 . . . . 0.0 108.485 169.18 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 89.3 m -130.6 134.88 47.35 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.173 1.389 . . . . 0.0 110.403 -174.365 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 22.1 pt20 -79.92 141.66 35.86 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.574 0.749 . . . . 0.0 111.887 173.851 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 72.3 mt -93.9 158.38 36.44 Favored Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 124.904 1.282 . . . . 0.0 111.675 178.171 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -65.56 -4.72 10.13 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 123.549 2.832 . . . . 0.0 113.848 174.209 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 21.2 m120 -65.19 -18.53 65.39 Favored 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 119.15 0.886 . . . . 0.0 113.044 169.97 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 95.66 -34.14 5.07 Favored Glycine 0 N--CA 1.474 1.168 0 C-N-CA 126.457 1.98 . . . . 0.0 114.241 169.884 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 90.4 mtt-85 -141.41 73.65 1.43 Allowed 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.571 1.549 . . . . 0.0 109.173 169.308 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -164.82 144.81 7.28 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 126.787 2.035 . . . . 0.0 108.087 178.706 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -142.65 147.35 35.61 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 -168.055 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -105.19 138.63 41.08 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.163 1.385 . . . . 0.0 110.917 168.884 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 31.5 mtt -121.42 108.66 13.93 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 126.238 1.815 . . . . 0.0 107.816 179.32 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 17.5 t -122.26 128.35 51.0 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 -165.994 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 12.9 t -88.32 124.9 41.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 125.269 1.428 . . . . 0.0 107.356 168.073 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 67.4 t -84.29 112.48 21.61 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 C-N-CA 124.916 1.287 . . . . 0.0 108.887 174.535 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 80.7 mtt85 54.97 70.39 0.63 Allowed 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.714 1.605 . . . . 0.0 111.656 175.997 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.64 128.46 36.05 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.196 0.998 . . . . 0.0 111.792 -174.391 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 10.1 mpt_? -89.22 161.94 16.16 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.945 1.298 . . . . 0.0 109.828 173.557 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 71.8 mtm180 -58.73 -23.72 60.32 Favored 'General case' 0 N--CA 1.484 1.255 0 O-C-N 120.628 -1.295 . . . . 0.0 113.578 172.676 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -55.01 -26.88 40.02 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.576 1.551 . . . . 0.0 113.367 167.99 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 34.9 m-20 -95.73 -1.22 50.33 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.584 1.554 . . . . 0.0 113.207 -169.46 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 69.4 m -64.4 138.31 58.35 Favored 'General case' 0 CA--C 1.544 0.727 0 O-C-N 120.401 -1.437 . . . . 0.0 111.643 169.837 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 160.1 -167.41 35.47 Favored Glycine 0 N--CA 1.473 1.12 0 O-C-N 121.167 -0.958 . . . . 0.0 113.608 178.866 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.8 m -93.84 145.54 24.53 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.464 0.706 . . . . 0.0 110.004 175.701 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -139.56 158.99 43.19 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.85 2.06 . . . . 0.0 110.281 -178.671 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.9 pp -152.83 167.16 29.97 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.96 0.904 . . . . 0.0 112.558 171.095 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 50.4 t -114.32 144.76 42.73 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.676 1.591 . . . . 0.0 110.935 -178.767 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -147.79 139.04 7.49 Favored Glycine 0 N--CA 1.472 1.094 0 C-N-CA 124.031 0.824 . . . . 0.0 113.906 177.584 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -109.46 159.21 17.23 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.728 1.211 . . . . 0.0 112.387 179.161 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.4 tt -146.68 131.77 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 125.321 1.448 . . . . 0.0 109.355 169.377 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.3 m -67.29 152.33 45.91 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.449 1.1 . . . . 0.0 111.92 -177.905 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 3.7 pp -70.72 -11.5 60.98 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 115.372 1.619 . . . . 0.0 115.372 -170.936 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -74.32 148.03 85.77 Favored Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 123.808 0.843 . . . . 0.0 112.069 174.924 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -67.54 -18.74 48.94 Favored 'Trans proline' 0 CA--C 1.54 0.775 0 C-N-CA 123.189 2.593 . . . . 0.0 113.383 -179.015 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -76.83 -10.15 59.17 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.839 1.256 . . . . 0.0 113.718 176.433 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.25 162.32 20.29 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.931 1.292 . . . . 0.0 114.024 -175.106 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -137.92 157.96 45.33 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.109 1.764 . . . . 0.0 109.434 174.75 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 65.4 mt -72.91 132.55 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 123.386 0.674 . . . . 0.0 110.944 -177.986 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -122.34 135.29 54.69 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.772 2.029 . . . . 0.0 110.093 173.389 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -112.65 148.0 35.56 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.181 0.992 . . . . 0.0 113.524 -167.662 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 69.8 m -84.58 -175.45 5.79 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.428 1.491 . . . . 0.0 111.918 168.867 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -63.35 156.48 25.68 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.121 0.968 . . . . 0.0 110.552 168.924 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -93.84 155.45 17.19 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.17 0.988 . . . . 0.0 111.613 172.855 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -147.79 159.96 43.25 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.141 1.376 . . . . 0.0 112.291 -176.029 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -104.12 138.44 40.61 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.913 1.285 . . . . 0.0 112.046 -175.013 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 46.9 tp -109.91 126.7 54.15 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 125.998 1.719 . . . . 0.0 108.688 169.212 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 70.9 ttt180 -118.34 119.38 34.46 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.975 1.71 . . . . 0.0 109.603 175.531 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 43.8 t -104.09 120.39 54.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 C-N-CA 124.341 1.057 . . . . 0.0 108.582 170.367 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 68.1 p -98.9 150.07 22.29 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.308 1.443 . . . . 0.0 109.727 175.435 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 37.1 mp0 -50.73 150.49 2.83 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.978 1.311 . . . . 0.0 112.867 -177.971 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 57.7 ttp180 . . . . . 0 C--O 1.236 0.353 0 C-N-CA 124.449 1.099 . . . . 0.0 109.496 -178.11 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 37.2 p . . . . . 0 N--CA 1.476 0.864 0 CA-C-O 120.574 0.226 . . . . 0.0 111.067 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -121.46 134.13 55.07 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.255 1.422 . . . . 0.0 110.117 178.533 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.4 m -140.83 157.45 67.53 Favored Pre-proline 0 N--CA 1.477 0.892 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 179.918 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -70.64 157.87 94.14 Favored 'Cis proline' 0 C--N 1.351 0.662 0 CA-C-N 119.327 0.795 . . . . 0.0 110.887 -8.993 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -57.69 -32.7 67.62 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 172.146 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 50.6 tp -138.93 120.37 14.96 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.531 1.533 . . . . 0.0 109.342 170.733 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 50.6 tp -100.62 127.27 47.07 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.524 1.53 . . . . 0.0 109.24 171.146 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.7 t -111.52 124.61 68.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 124.099 0.96 . . . . 0.0 108.562 171.805 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.1 m -127.58 164.32 28.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 124.493 1.117 . . . . 0.0 111.562 173.959 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 16.8 m -88.33 151.27 22.73 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.681 1.193 . . . . 0.0 110.472 173.662 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.12 120.53 2.45 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.942 1.697 . . . . 0.0 112.563 171.634 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.18 1.08 89.64 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 125.868 1.699 . . . . 0.0 115.408 179.692 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -85.13 157.26 20.73 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 119.65 1.725 . . . . 0.0 111.914 175.744 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -82.54 123.53 29.29 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.696 0.798 . . . . 0.0 110.353 177.548 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -104.55 123.79 48.16 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.667 1.187 . . . . 0.0 110.928 -178.529 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 36.0 m -132.3 126.87 34.37 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.002 0.921 . . . . 0.0 111.516 -175.963 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -100.37 153.98 18.88 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 126.1 1.76 . . . . 0.0 110.837 171.027 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 39.4 m -101.53 128.41 47.79 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 125.266 1.426 . . . . 0.0 108.572 169.759 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 95.6 m -124.67 128.77 49.34 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.606 1.162 . . . . 0.0 109.538 170.603 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.9 m -111.0 127.85 55.66 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.744 0.818 . . . . 0.0 109.884 -173.923 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 . . . . . 0 CA--C 1.534 0.339 0 C-N-CA 124.239 1.016 . . . . 0.0 110.874 174.912 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 49.2 p90 . . . . . 0 CA--C 1.54 0.57 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 24.2 t -125.77 119.93 56.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 125.0 1.32 . . . . 0.0 107.878 168.648 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 59.0 tp -99.43 139.4 35.14 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 124.819 1.247 . . . . 0.0 108.662 169.601 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 9.7 m-80 -133.8 152.8 51.98 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.761 1.224 . . . . 0.0 111.193 -170.809 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 24.0 t90 -128.19 139.41 52.49 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.871 1.268 . . . . 0.0 111.04 175.469 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -135.31 143.41 46.16 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 114.677 1.362 . . . . 0.0 114.677 -170.404 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 55.9 ttp85 -93.14 144.46 25.26 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.913 1.685 . . . . 0.0 107.104 165.614 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 28.9 mtp -96.91 145.95 25.41 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 118.945 0.793 . . . . 0.0 112.244 172.62 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 59.3 m -102.89 158.64 31.35 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 125.029 1.331 . . . . 0.0 111.301 169.809 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_exo -56.6 -30.97 85.36 Favored 'Trans proline' 0 C--N 1.355 0.917 0 C-N-CA 124.405 3.403 . . . . 0.0 115.163 -172.97 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 14.3 m -77.02 11.86 1.62 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.001 1.32 . . . . 0.0 113.655 178.094 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 46.3 t30 69.12 25.4 5.81 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 127.164 2.186 . . . . 0.0 112.445 -176.913 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -92.72 170.51 9.66 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.203 1.001 . . . . 0.0 110.628 172.85 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 9.9 p -134.74 152.55 51.85 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.457 1.503 . . . . 0.0 111.555 -174.722 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 43.4 t0 -136.47 125.77 24.84 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.701 1.601 . . . . 0.0 110.042 -177.823 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 12.7 ttmm -75.05 126.13 30.38 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.235 0.541 . . . . 0.0 110.734 -175.875 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 91.0 mt -95.37 -49.43 5.45 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.248 1.419 . . . . 0.0 111.147 -177.8 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -160.82 176.72 11.16 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.41 1.484 . . . . 0.0 110.445 177.296 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -152.85 166.7 31.46 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.862 1.265 . . . . 0.0 112.043 -174.857 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -137.72 115.27 9.6 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 126.033 1.733 . . . . 0.0 109.117 172.587 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo . . . . . 0 C--N 1.352 0.715 0 CA-C-N 120.289 1.139 . . . . 0.0 113.935 -5.803 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 . . . . . 0 N--CA 1.472 0.625 0 N-CA-C 114.271 1.212 . . . . 0.0 114.271 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -101.91 127.23 48.84 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.916 1.286 . . . . 0.0 110.118 176.498 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -134.2 143.12 47.67 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.412 1.085 . . . . 0.0 112.197 -171.133 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 26.0 t -126.56 127.7 70.54 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 125.14 1.376 . . . . 0.0 109.232 168.562 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 90.3 m -130.52 137.38 49.7 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.479 1.512 . . . . 0.0 110.779 -174.286 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 65.4 tt0 -86.02 134.73 33.83 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.119 0.968 . . . . 0.0 110.59 172.188 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 65.8 mt -87.13 158.92 52.07 Favored Pre-proline 0 CA--C 1.542 0.635 0 C-N-CA 124.203 1.001 . . . . 0.0 112.064 -179.281 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -63.97 -6.97 12.15 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 123.645 2.897 . . . . 0.0 114.017 173.8 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -64.58 -26.04 68.23 Favored 'General case' 0 CA--C 1.552 1.022 0 CA-C-N 119.559 1.072 . . . . 0.0 112.191 169.094 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 92.98 -34.04 4.75 Favored Glycine 0 CA--C 1.53 1.018 0 C-N-CA 126.556 2.027 . . . . 0.0 113.591 174.637 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 22.9 ptt180 -130.75 73.54 1.55 Allowed 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 122.835 1.302 . . . . 0.0 110.378 171.003 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -175.47 143.94 0.66 Allowed 'General case' 0 C--O 1.237 0.398 0 C-N-CA 127.393 2.277 . . . . 0.0 109.14 -177.663 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -142.51 148.31 37.43 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -168.782 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 10.0 m170 -107.31 134.88 49.73 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.26 1.424 . . . . 0.0 111.621 170.442 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -119.92 121.36 38.84 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 126.192 1.797 . . . . 0.0 107.923 178.002 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 22.7 t -133.78 137.04 44.93 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 116.285 1.958 . . . . 0.0 116.285 -166.721 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 48.4 t -96.58 116.26 38.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 C-N-CA 126.906 2.083 . . . . 0.0 107.318 168.265 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 88.5 t -76.83 127.29 37.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 123.657 0.783 . . . . 0.0 109.026 169.599 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 54.4 ttt85 54.75 71.33 0.54 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.931 1.693 . . . . 0.0 111.551 176.864 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -69.83 129.42 39.51 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.627 0.771 . . . . 0.0 110.98 -177.535 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 37.7 mmm-85 -103.74 161.91 13.53 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 126.019 1.727 . . . . 0.0 110.268 179.492 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 3.2 mmm180 -51.81 -34.28 39.37 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 121.009 -1.057 . . . . 0.0 113.418 -179.628 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -66.89 -19.49 65.74 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.408 1.483 . . . . 0.0 115.001 176.81 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -75.9 -13.7 60.26 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 119.831 1.196 . . . . 0.0 113.144 177.992 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.2 m -62.83 129.16 39.23 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 120.661 -1.275 . . . . 0.0 112.156 179.998 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 161.3 -166.46 35.84 Favored Glycine 0 CA--C 1.529 0.924 0 C-N-CA 124.111 0.863 . . . . 0.0 113.246 -173.583 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.6 m -96.83 144.28 26.94 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.664 1.186 . . . . 0.0 110.833 -177.244 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -143.03 158.29 43.74 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.363 1.865 . . . . 0.0 111.321 -175.553 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.2 pp -158.64 166.53 31.84 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.555 1.142 . . . . 0.0 112.208 174.295 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 71.3 m -113.61 162.12 16.6 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.889 1.275 . . . . 0.0 111.268 177.384 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -156.72 133.89 3.81 Favored Glycine 0 N--CA 1.471 0.977 0 O-C-N 121.529 -0.732 . . . . 0.0 114.12 176.462 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -114.52 147.85 38.79 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.285 1.034 . . . . 0.0 112.685 -178.451 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 16.9 tt -153.96 147.97 13.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.296 1.438 . . . . 0.0 111.035 -179.389 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 66.1 m -77.63 150.73 34.58 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 120.918 -1.114 . . . . 0.0 110.689 169.493 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.86 -4.9 37.72 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 115.413 1.635 . . . . 0.0 115.413 -174.333 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -75.05 147.18 83.3 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 124.68 1.192 . . . . 0.0 111.894 174.134 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -68.77 -17.14 42.31 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 123.434 2.756 . . . . 0.0 113.77 -176.613 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -73.66 -16.14 61.22 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.532 1.133 . . . . 0.0 113.575 176.268 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -71.67 168.1 18.43 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.137 1.375 . . . . 0.0 113.765 -176.052 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.54 149.06 35.24 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.125 1.77 . . . . 0.0 108.664 176.866 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 34.0 mt -75.48 121.61 27.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 123.893 0.877 . . . . 0.0 110.928 -175.123 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 36.6 tptt -81.81 115.31 20.97 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.683 0.793 . . . . 0.0 109.769 168.985 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -108.91 158.87 17.28 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.723 2.009 . . . . 0.0 110.587 174.226 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 5.6 t -143.96 -168.03 2.75 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.369 1.068 . . . . 0.0 112.156 176.384 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 98.7 mt -60.82 117.5 5.48 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.874 1.669 . . . . 0.0 111.884 -172.478 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 20.2 ptp180 -66.32 157.86 30.61 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.656 1.582 . . . . 0.0 113.632 -174.67 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -122.36 165.75 15.79 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 127.038 2.135 . . . . 0.0 111.52 -175.057 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -128.01 143.13 51.07 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.585 1.154 . . . . 0.0 111.885 -177.657 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 56.4 tp -113.27 135.94 53.29 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 126.196 1.798 . . . . 0.0 109.97 172.563 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -126.66 123.23 37.1 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.81 1.644 . . . . 0.0 109.539 169.726 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 46.5 t -103.01 124.35 57.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 107.143 -1.429 . . . . 0.0 107.143 169.275 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 67.5 p -101.3 155.3 18.12 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.313 1.445 . . . . 0.0 110.904 177.25 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -58.75 150.81 22.65 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.752 0.787 . . . . 0.0 112.845 178.645 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.466 0.349 0 C-N-CA 124.323 1.049 . . . . 0.0 109.049 -179.471 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 85.5 m . . . . . 0 N--CA 1.476 0.863 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -145.08 114.45 7.11 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.152 1.781 . . . . 0.0 109.755 172.793 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 69.2 m -140.91 160.06 59.81 Favored Pre-proline 0 N--CA 1.479 0.976 0 C-N-CA 124.762 1.225 . . . . 0.0 113.069 -170.895 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -71.21 158.71 94.9 Favored 'Cis proline' 0 C--N 1.353 0.788 0 CA-C-N 120.152 1.09 . . . . 0.0 111.531 -4.261 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.55 -25.21 64.35 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 175.387 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 45.2 tp -142.45 122.55 13.73 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.445 1.498 . . . . 0.0 109.044 169.988 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 61.6 tp -108.74 125.47 51.96 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.21 1.404 . . . . 0.0 108.881 169.75 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 12.8 p -108.79 129.33 63.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 123.877 0.871 . . . . 0.0 109.653 169.629 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 28.5 m -130.23 163.09 36.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 124.952 1.301 . . . . 0.0 111.42 173.07 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 16.3 m -84.77 147.47 26.84 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.079 0.951 . . . . 0.0 109.963 170.223 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 64.7 tt0 -56.43 124.95 19.91 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 124.931 1.292 . . . . 0.0 110.696 173.524 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.91 -2.78 84.47 Favored Glycine 0 CA--C 1.532 1.139 0 C-N-CA 126.085 1.802 . . . . 0.0 114.781 -174.795 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -87.58 160.99 17.98 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 119.35 1.575 . . . . 0.0 111.748 172.263 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -87.05 121.44 29.51 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.328 1.051 . . . . 0.0 110.495 177.331 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -97.61 128.49 44.37 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.393 1.077 . . . . 0.0 110.601 177.481 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 97.0 m -132.68 127.05 33.97 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 119.336 0.971 . . . . 0.0 111.84 176.125 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -100.99 159.48 15.17 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.609 1.964 . . . . 0.0 110.409 169.302 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 59.1 m -103.8 134.28 47.38 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.144 1.378 . . . . 0.0 109.312 171.451 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 3.3 t -137.15 142.27 42.22 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.579 1.152 . . . . 0.0 112.366 177.943 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 90.5 p -147.05 154.18 40.87 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 121.065 -1.022 . . . . 0.0 113.115 -176.877 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 . . . . . 0 N--CA 1.469 0.499 0 C-N-CA 126.429 1.892 . . . . 0.0 112.34 -172.467 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 55.6 p90 . . . . . 0 CA--C 1.539 0.524 0 CA-C-O 120.996 0.426 . . . . 0.0 112.134 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 48.8 t -95.98 127.86 47.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 125.154 1.381 . . . . 0.0 107.274 169.909 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.0 tt -99.37 119.75 38.47 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 173.277 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 23.2 m-80 -112.79 149.41 33.07 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.14 1.376 . . . . 0.0 111.146 179.349 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 11.5 t90 -119.25 142.1 48.34 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.72 1.208 . . . . 0.0 111.7 175.807 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -137.15 149.12 47.07 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.705 1.202 . . . . 0.0 113.769 -169.976 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 79.0 ttt-85 -108.04 140.28 41.44 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.397 1.479 . . . . 0.0 108.252 167.348 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 29.0 mtp -84.41 145.91 27.94 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.59 0.632 . . . . 0.0 112.35 178.345 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 66.0 m -107.64 153.2 41.57 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 125.266 1.426 . . . . 0.0 112.026 179.912 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -56.0 -30.03 76.34 Favored 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 124.69 3.593 . . . . 0.0 115.202 -177.286 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.3 m -76.98 10.16 2.49 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.843 1.257 . . . . 0.0 113.491 178.844 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 67.96 44.85 1.44 Allowed 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.825 2.05 . . . . 0.0 110.585 -175.223 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -124.09 -172.69 2.59 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.518 1.527 . . . . 0.0 109.946 177.892 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.2 p -146.01 148.13 32.38 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.719 1.608 . . . . 0.0 110.403 -174.333 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -124.69 132.59 53.39 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 124.126 0.97 . . . . 0.0 111.258 173.196 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 29.9 ttmt -76.2 126.0 30.19 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.684 1.193 . . . . 0.0 110.766 -179.41 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 66.3 mt -101.54 -51.98 3.33 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 125.501 1.52 . . . . 0.0 111.75 -170.412 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -160.46 160.86 32.6 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 127.009 2.123 . . . . 0.0 108.767 -171.963 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.57 165.4 32.95 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.65 0.78 . . . . 0.0 111.867 -174.936 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -138.19 115.61 9.31 Favored Pre-proline 0 CA--C 1.545 0.763 0 C-N-CA 124.678 1.191 . . . . 0.0 110.749 171.105 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo . . . . . 0 C--N 1.352 0.724 0 CA-C-N 119.253 0.769 . . . . 0.0 110.941 -11.659 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 48.6 mtm180 . . . . . 0 N--CA 1.472 0.627 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 80.3 m-85 -69.81 125.78 27.75 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.01 1.324 . . . . 0.0 111.24 173.025 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 8.2 tmm_? -144.47 139.9 28.59 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.55 1.54 . . . . 0.0 111.915 -169.623 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 65.2 t -119.31 133.46 66.06 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 C-N-CA 125.122 1.369 . . . . 0.0 110.378 172.462 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 45.2 m -127.16 134.42 50.18 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 125.509 1.523 . . . . 0.0 110.473 177.767 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -84.08 138.04 33.26 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.743 1.217 . . . . 0.0 111.022 175.459 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 45.6 mt -93.73 159.19 35.24 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 124.828 1.251 . . . . 0.0 111.695 177.768 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -65.56 -4.47 9.67 Favored 'Trans proline' 0 CA--C 1.542 0.92 0 C-N-CA 123.538 2.825 . . . . 0.0 114.293 174.976 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -68.23 -13.11 62.0 Favored 'General case' 0 CA--C 1.553 1.058 0 CA-C-N 119.454 1.025 . . . . 0.0 112.948 169.825 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 93.84 -34.12 4.83 Favored Glycine 0 N--CA 1.475 1.272 0 C-N-CA 126.66 2.076 . . . . 0.0 114.889 169.327 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 31.0 ptt-85 -146.12 73.63 1.34 Allowed 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 123.967 1.842 . . . . 0.0 110.138 169.792 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -161.58 141.03 10.12 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 128.872 2.869 . . . . 0.0 106.232 -176.349 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -146.09 148.5 32.7 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 -166.696 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 -100.08 122.33 42.78 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.182 1.393 . . . . 0.0 110.135 168.462 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -105.74 105.81 16.02 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 126.653 1.981 . . . . 0.0 108.291 179.975 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.2 m -114.69 145.6 41.85 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -168.704 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 11.0 t -116.82 106.41 20.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 126.588 1.955 . . . . 0.0 106.37 167.313 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 79.4 t -68.61 127.22 30.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 174.069 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 57.4 ttm-85 53.87 68.14 0.89 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.1 1.36 . . . . 0.0 111.457 170.74 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -70.76 138.21 50.28 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.0 0.92 . . . . 0.0 112.118 -173.883 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 8.7 mpt_? -107.67 158.63 17.11 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 126.028 1.731 . . . . 0.0 109.743 175.211 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 40.1 mtp180 -56.15 -32.27 64.13 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 -172.245 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 5.0 p-10 -64.67 -18.68 65.19 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 114.998 1.481 . . . . 0.0 114.998 175.955 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -71.62 -24.78 61.94 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.085 0.857 . . . . 0.0 112.317 177.169 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 19.3 m -54.71 141.55 31.86 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.254 1.022 . . . . 0.0 112.746 -178.37 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 146.98 -163.77 28.61 Favored Glycine 0 N--CA 1.471 1.029 0 C-N-CA 124.432 1.015 . . . . 0.0 113.083 -174.414 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.3 m -92.0 141.04 29.05 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.406 1.082 . . . . 0.0 110.599 -178.308 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 33.6 m-85 -132.57 159.63 38.92 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.779 2.032 . . . . 0.0 110.942 178.818 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -166.25 155.84 11.76 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.61 1.564 . . . . 0.0 112.033 179.909 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 30.8 m -99.53 159.93 14.66 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.873 0.869 . . . . 0.0 112.036 172.86 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -148.06 122.12 1.47 Allowed Glycine 0 CA--C 1.525 0.713 0 C-N-CA 124.836 1.208 . . . . 0.0 111.954 169.668 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -91.55 156.77 17.43 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.592 0.757 . . . . 0.0 111.437 173.886 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.1 tt -152.99 133.05 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 124.453 1.101 . . . . 0.0 110.526 176.654 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 8.5 m -65.42 161.47 19.78 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.739 1.216 . . . . 0.0 113.464 -175.079 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -60.51 -21.78 62.85 Favored 'General case' 0 CA--C 1.547 0.827 0 N-CA-C 115.573 1.694 . . . . 0.0 115.573 -179.258 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -78.33 143.5 64.69 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 124.318 1.047 . . . . 0.0 112.702 -174.755 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -57.35 -25.6 66.41 Favored 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 123.556 2.837 . . . . 0.0 114.514 173.349 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -81.63 -0.79 44.08 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 125.058 1.343 . . . . 0.0 113.811 179.723 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.43 167.6 10.37 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.917 1.287 . . . . 0.0 114.164 -176.242 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -143.06 153.75 43.26 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 126.508 1.923 . . . . 0.0 108.811 179.717 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 99.1 mt -71.64 123.62 26.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 CA-C-O 121.583 0.706 . . . . 0.0 111.98 -174.793 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.92 99.13 11.91 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.801 1.64 . . . . 0.0 106.83 167.326 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -84.6 137.89 33.03 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.323 0.649 . . . . 0.0 111.187 -171.497 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 8.1 t -94.89 -175.43 3.56 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.537 1.135 . . . . 0.0 113.098 179.613 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 9.8 mp -60.94 149.7 35.64 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.347 1.859 . . . . 0.0 111.285 178.788 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -92.76 141.87 27.97 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.384 1.074 . . . . 0.0 109.808 172.155 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -147.26 164.16 34.08 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.755 1.222 . . . . 0.0 111.839 175.875 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -109.44 139.86 43.9 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.217 1.007 . . . . 0.0 112.671 -170.492 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 64.1 tp -108.48 132.15 54.1 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 125.915 1.686 . . . . 0.0 108.963 168.614 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 62.5 ttm-85 -123.83 115.92 22.11 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.754 1.622 . . . . 0.0 109.702 174.028 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 48.7 t -102.78 113.81 40.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 124.372 1.069 . . . . 0.0 108.75 172.006 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 65.0 p -93.65 146.83 23.54 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.605 1.562 . . . . 0.0 109.885 177.95 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -62.79 148.7 46.08 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 121.413 -0.804 . . . . 0.0 112.91 -175.782 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 45.8 ttt85 . . . . . 0 N--CA 1.467 0.383 0 C-N-CA 124.047 0.939 . . . . 0.0 110.257 -173.943 . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.8 p . . . . . 0 N--CA 1.473 0.688 0 CA-C-O 121.465 0.65 . . . . 0.0 112.125 . . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -146.33 120.22 9.33 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.912 1.685 . . . . 0.0 109.159 -178.159 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 80.5 p -140.97 159.37 62.25 Favored Pre-proline 0 CA--C 1.55 0.947 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -169.872 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -69.59 161.46 85.63 Favored 'Cis proline' 0 C--N 1.354 0.833 0 CA-C-N 119.551 0.875 . . . . 0.0 111.501 -6.434 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.48 -24.65 67.91 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 113.169 0.803 . . . . 0.0 113.169 176.052 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 46.7 tp -140.4 120.77 14.01 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.568 1.547 . . . . 0.0 108.761 169.854 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 55.4 tp -105.96 125.79 51.42 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.267 1.427 . . . . 0.0 109.029 170.635 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.4 t -110.27 124.39 66.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 124.082 0.953 . . . . 0.0 108.563 173.041 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.6 m -128.3 164.71 29.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 C-N-CA 124.644 1.178 . . . . 0.0 111.635 174.421 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 18.3 m -90.83 148.8 22.27 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.707 1.203 . . . . 0.0 110.437 173.962 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -53.18 123.68 12.45 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.823 1.249 . . . . 0.0 111.406 176.428 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 89.12 -1.56 82.92 Favored Glycine 0 CA--C 1.533 1.199 0 C-N-CA 125.869 1.7 . . . . 0.0 114.826 -177.298 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -86.72 156.68 19.86 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 119.597 1.698 . . . . 0.0 111.877 173.217 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -83.88 123.68 30.18 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.856 0.862 . . . . 0.0 110.294 175.682 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -101.48 129.15 47.48 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.478 1.111 . . . . 0.0 110.894 179.182 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 65.3 m -132.77 126.61 32.8 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.895 0.878 . . . . 0.0 111.533 -178.573 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -101.68 152.12 21.21 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.729 1.612 . . . . 0.0 110.812 169.747 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.6 m -100.72 126.77 47.29 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.639 1.576 . . . . 0.0 109.236 175.853 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 49.4 t -117.97 138.5 52.13 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.382 1.873 . . . . 0.0 111.124 177.561 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 74.1 m -137.55 126.93 24.82 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.528 -0.733 . . . . 0.0 110.17 176.054 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 . . . . . 0 CA--C 1.534 0.329 0 C-N-CA 125.707 1.603 . . . . 0.0 113.978 175.838 . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 46.1 p90 . . . . . 0 CA--C 1.538 0.489 0 CA-C-O 121.012 0.434 . . . . 0.0 112.075 . . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 93.8 t -95.9 125.36 48.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 125.119 1.368 . . . . 0.0 107.332 169.378 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 56.8 tp -99.95 136.94 39.11 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.978 0.911 . . . . 0.0 110.29 178.059 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 -127.25 160.29 31.74 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.397 1.479 . . . . 0.0 110.627 -176.58 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 19.0 t90 -126.38 139.79 53.0 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.075 1.35 . . . . 0.0 111.427 179.606 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -136.13 144.52 45.11 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.763 1.225 . . . . 0.0 113.749 -171.82 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 56.8 ttt85 -102.49 140.15 37.14 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.886 1.674 . . . . 0.0 107.789 167.162 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 35.4 mtp -89.64 145.94 24.89 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 118.98 0.809 . . . . 0.0 112.318 176.235 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.1 p -89.16 162.06 38.61 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 123.824 0.849 . . . . 0.0 111.991 172.141 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -67.79 -18.87 47.52 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 122.755 2.303 . . . . 0.0 112.642 172.413 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.6 m -80.8 3.99 20.58 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 124.744 1.218 . . . . 0.0 113.042 170.83 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 63.7 t30 70.97 26.38 3.6 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 127.329 2.252 . . . . 0.0 113.24 178.5 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -96.71 -172.7 2.54 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.408 1.083 . . . . 0.0 109.755 169.705 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.0 p -141.6 145.16 34.71 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.619 1.567 . . . . 0.0 110.698 -174.372 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -124.72 130.58 52.69 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 125.035 1.334 . . . . 0.0 110.776 175.821 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 37.5 tttm -83.77 119.1 24.4 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.61 1.164 . . . . 0.0 111.66 -173.134 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 57.5 mt -93.55 -49.19 6.01 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.559 1.544 . . . . 0.0 112.446 -169.278 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -166.5 176.38 7.39 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.289 1.836 . . . . 0.0 110.546 -173.798 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -158.48 163.47 37.1 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.721 1.209 . . . . 0.0 112.674 -175.142 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -137.62 122.72 12.49 Favored Pre-proline 0 CA--C 1.549 0.904 0 C-N-CA 125.569 1.548 . . . . 0.0 109.802 169.977 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo . . . . . 0 C--N 1.352 0.726 0 CA-C-N 120.056 1.056 . . . . 0.0 111.745 -4.251 . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 1.7 ptm85 . . . . . 0 N--CA 1.471 0.592 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 . . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -101.01 126.25 47.67 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.196 1.398 . . . . 0.0 110.267 179.065 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 79.3 mtm180 -134.25 149.81 50.98 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.705 1.202 . . . . 0.0 111.858 -178.24 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 46.6 t -126.5 130.98 71.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 125.112 1.365 . . . . 0.0 109.334 171.11 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 92.4 m -130.53 132.73 45.74 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.687 1.195 . . . . 0.0 110.233 -179.48 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -80.58 141.74 34.76 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.37 0.668 . . . . 0.0 111.824 173.548 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 26.4 mt -90.36 158.29 43.65 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 124.03 0.932 . . . . 0.0 111.342 173.604 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -66.73 -4.69 11.58 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 123.61 2.873 . . . . 0.0 113.97 174.814 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 23.7 m120 -64.31 -18.99 65.13 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.167 0.987 . . . . 0.0 113.428 172.439 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 95.18 -20.92 46.95 Favored Glycine 0 N--CA 1.474 1.205 0 C-N-CA 125.77 1.652 . . . . 0.0 115.392 169.715 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -154.5 73.53 0.91 Allowed 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.468 1.507 . . . . 0.0 109.914 171.288 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -170.39 136.97 1.39 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 127.707 2.403 . . . . 0.0 107.662 -171.99 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 70.8 m-85 -145.18 145.81 31.5 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.891 0.877 . . . . 0.0 112.916 -168.192 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -101.76 125.83 48.5 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.236 1.415 . . . . 0.0 111.433 169.998 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -104.91 112.96 26.28 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.819 2.048 . . . . 0.0 108.419 174.884 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 67.6 m -122.03 129.18 52.22 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 115.147 1.536 . . . . 0.0 115.147 -167.954 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 44.3 t -96.36 116.49 38.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 125.916 1.687 . . . . 0.0 107.532 168.288 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 85.7 t -78.63 125.84 38.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 124.158 0.983 . . . . 0.0 110.177 176.412 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 51.11 66.71 1.1 Allowed 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 126.218 1.807 . . . . 0.0 112.157 175.456 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.42 130.48 43.19 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.508 1.123 . . . . 0.0 111.572 -173.352 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.03 169.58 8.59 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.952 1.701 . . . . 0.0 110.274 171.706 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 27.7 mtp180 -56.29 -30.71 62.86 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 121.208 -0.932 . . . . 0.0 113.373 -177.098 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 29.7 t30 -60.43 -27.94 67.88 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 124.967 1.307 . . . . 0.0 114.387 172.299 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -75.62 -14.54 60.38 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.289 0.95 . . . . 0.0 113.086 175.536 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 34.2 m -61.63 141.34 57.86 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 120.231 1.378 . . . . 0.0 111.65 177.385 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 150.41 -169.67 30.34 Favored Glycine 0 N--CA 1.473 1.138 0 C-N-CA 124.377 0.989 . . . . 0.0 113.345 -176.997 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.3 m -94.88 142.45 27.45 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.271 1.028 . . . . 0.0 110.517 -178.057 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -138.82 162.51 34.58 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.137 1.775 . . . . 0.0 111.71 -179.144 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -161.75 157.56 24.46 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.578 1.551 . . . . 0.0 111.783 174.183 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 25.9 p -104.68 151.73 23.35 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.456 0.702 . . . . 0.0 111.754 168.834 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -148.47 133.05 4.41 Favored Glycine 0 N--CA 1.471 0.986 0 C-N-CA 124.709 1.147 . . . . 0.0 112.784 -177.836 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -110.57 156.02 21.51 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -176.175 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 19.7 tt -137.89 136.13 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 125.698 1.599 . . . . 0.0 109.921 174.026 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 14.4 t -62.77 157.52 20.97 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.774 0.83 . . . . 0.0 112.953 176.935 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.49 -9.65 50.31 Favored 'General case' 0 CA--C 1.546 0.827 0 N-CA-C 114.274 1.213 . . . . 0.0 114.274 169.95 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -68.56 149.18 98.07 Favored Pre-proline 0 CA--C 1.553 1.078 0 C-N-CA 124.341 1.056 . . . . 0.0 112.428 178.592 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -69.32 -26.13 29.93 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 122.951 2.434 . . . . 0.0 112.812 178.853 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.8 ptmt -86.04 5.22 34.51 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.218 1.407 . . . . 0.0 114.581 178.055 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.41 163.17 18.87 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.799 1.24 . . . . 0.0 114.214 -173.335 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.96 157.25 43.42 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 126.308 1.843 . . . . 0.0 108.648 176.875 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 61.7 mt -78.31 124.38 36.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 123.861 0.865 . . . . 0.0 111.269 -174.482 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 24.1 tptp -94.55 126.93 40.15 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.297 1.439 . . . . 0.0 109.613 168.839 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -84.38 157.02 21.57 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.293 1.037 . . . . 0.0 112.059 175.237 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 97.0 p -108.33 -166.13 1.1 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 125.241 1.416 . . . . 0.0 111.099 168.128 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 11.1 mp -63.16 151.02 41.41 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.347 1.059 . . . . 0.0 111.715 172.661 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -90.69 142.74 27.45 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.075 0.95 . . . . 0.0 109.985 171.542 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -135.0 152.93 52.18 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 125.322 1.449 . . . . 0.0 111.809 178.74 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -104.51 138.87 40.24 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.661 1.184 . . . . 0.0 111.687 -177.9 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 50.9 tp -108.81 129.28 55.39 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 125.905 1.682 . . . . 0.0 109.202 169.348 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 60.6 ttt85 -121.69 120.22 34.07 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.795 1.638 . . . . 0.0 109.71 173.664 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 39.1 t -104.22 118.91 52.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 124.177 0.991 . . . . 0.0 109.045 171.626 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 67.4 p -98.74 154.77 17.74 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 126.114 1.766 . . . . 0.0 110.459 178.266 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -65.85 144.78 56.61 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.674 -0.641 . . . . 0.0 112.21 -177.367 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 35.9 ttt85 . . . . . 0 N--CA 1.467 0.411 0 C-N-CA 124.577 1.151 . . . . 0.0 109.862 179.169 . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.7 t . . . . . 0 N--CA 1.47 0.565 0 N-CA-C 112.802 0.668 . . . . 0.0 112.802 . . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 82.9 t80 -149.05 117.46 6.49 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.593 2.357 . . . . 0.0 108.647 -176.603 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 91.8 p -140.96 159.35 62.36 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 124.554 1.142 . . . . 0.0 113.558 -169.032 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -70.35 164.98 79.55 Favored 'Cis proline' 0 C--N 1.355 0.893 0 CA-C-N 119.987 1.031 . . . . 0.0 112.221 -2.535 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.05 -24.94 68.15 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 175.573 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 40.2 tp -143.55 119.03 10.32 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 125.772 1.629 . . . . 0.0 108.855 169.847 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 56.6 tp -102.1 124.39 47.63 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.656 1.182 . . . . 0.0 108.859 169.536 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.8 t -110.17 124.51 66.98 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 172.756 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 30.5 m -126.06 163.56 27.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 C-N-CA 124.388 1.075 . . . . 0.0 111.781 172.398 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 35.1 m -92.53 144.95 24.83 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.031 0.932 . . . . 0.0 109.863 171.836 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -49.65 124.59 9.86 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.333 1.453 . . . . 0.0 112.579 -179.262 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 91.52 -3.89 79.26 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 126.052 1.787 . . . . 0.0 114.818 -177.415 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -84.75 157.64 20.97 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.585 1.692 . . . . 0.0 112.088 174.929 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -83.61 117.65 23.3 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.84 0.856 . . . . 0.0 110.478 175.64 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -97.83 114.46 26.51 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.152 0.981 . . . . 0.0 111.134 -177.3 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 30.5 m -117.56 126.5 52.68 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.758 0.823 . . . . 0.0 111.793 -177.164 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -100.89 159.51 15.14 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.527 1.931 . . . . 0.0 109.969 169.385 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 93.3 m -102.36 139.16 38.33 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.346 1.458 . . . . 0.0 108.699 169.669 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 46.8 t -130.35 146.33 51.92 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.707 1.203 . . . . 0.0 111.234 171.062 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 16.0 t -149.54 133.62 17.18 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 121.347 -0.846 . . . . 0.0 111.342 179.044 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 18.5 m-85 . . . . . 0 N--CA 1.467 0.41 0 C-N-CA 127.779 2.432 . . . . 0.0 111.69 -179.103 . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 44.9 p90 . . . . . 0 CA--C 1.543 0.678 0 N-CA-C 111.437 0.162 . . . . 0.0 111.437 . . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 22.4 t -96.0 128.04 47.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 171.05 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 18.8 tp -105.12 139.11 40.28 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.911 0.884 . . . . 0.0 110.072 171.726 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 14.8 m-80 -132.94 150.38 52.16 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.582 1.553 . . . . 0.0 110.644 -169.698 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 9.4 t90 -121.71 137.55 54.71 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.201 1.0 . . . . 0.0 111.758 -178.493 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -134.07 144.32 48.56 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.565 1.146 . . . . 0.0 113.155 -175.434 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -104.89 140.08 38.68 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.028 1.331 . . . . 0.0 108.438 168.251 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 27.2 mtp -87.12 141.82 28.38 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 118.717 0.69 . . . . 0.0 111.956 178.879 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 50.2 m -92.81 157.98 38.64 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 124.888 1.275 . . . . 0.0 111.919 176.562 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_exo -55.73 -33.8 88.82 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 123.919 3.079 . . . . 0.0 114.113 176.48 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.7 m -77.03 9.55 2.91 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.182 1.393 . . . . 0.0 113.768 176.932 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 26.8 m120 70.42 20.9 5.85 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 127.336 2.254 . . . . 0.0 113.359 -179.016 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -89.99 -173.73 3.98 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.482 1.113 . . . . 0.0 110.549 170.555 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.9 p -144.15 145.93 32.43 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.779 1.632 . . . . 0.0 110.507 -175.635 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -123.15 132.4 54.06 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.648 1.179 . . . . 0.0 111.192 175.243 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -79.01 126.87 31.26 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.921 0.888 . . . . 0.0 111.382 -177.892 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 59.4 mt -99.75 -45.15 5.84 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.984 1.313 . . . . 0.0 112.472 -169.968 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -173.99 175.9 2.69 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.713 2.405 . . . . 0.0 110.282 -174.102 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.55 168.83 25.19 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.206 1.403 . . . . 0.0 112.379 -178.544 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -144.66 122.29 6.53 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 125.64 1.576 . . . . 0.0 110.042 169.481 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo . . . . . 0 C--N 1.352 0.759 0 CA-C-N 120.435 1.191 . . . . 0.0 112.582 -9.319 . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 44.5 mtp-105 . . . . . 0 N--CA 1.474 0.774 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 . . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -92.03 127.88 37.67 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.922 1.289 . . . . 0.0 109.736 175.625 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -131.15 144.16 51.17 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.19 1.396 . . . . 0.0 110.804 -175.867 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 47.8 t -126.57 128.28 71.05 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 124.846 1.258 . . . . 0.0 108.986 176.478 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 88.5 m -125.98 132.31 52.07 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.82 1.248 . . . . 0.0 110.287 -176.939 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -88.13 137.94 31.88 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.024 0.929 . . . . 0.0 110.407 172.735 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 44.2 mt -87.47 158.7 51.31 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 124.745 1.218 . . . . 0.0 111.433 177.669 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -65.42 -2.71 6.46 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 123.529 2.819 . . . . 0.0 114.293 175.85 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -63.52 -26.08 68.54 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 119.643 1.11 . . . . 0.0 112.861 169.735 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 98.61 -22.22 42.05 Favored Glycine 0 N--CA 1.476 1.308 0 C-N-CA 125.696 1.617 . . . . 0.0 114.273 174.579 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -154.48 73.65 0.92 Allowed 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.519 1.528 . . . . 0.0 110.166 169.381 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 17.9 t0 -163.56 141.48 7.6 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 128.919 2.888 . . . . 0.0 106.819 178.486 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -146.42 155.75 42.8 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 -167.188 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 56.7 m170 -116.15 147.61 41.19 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 126.043 1.737 . . . . 0.0 110.955 168.502 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 33.3 mtt -132.94 112.96 12.3 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.622 1.569 . . . . 0.0 109.381 -178.009 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 68.0 m -118.41 126.21 51.59 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 -167.561 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 19.7 t -90.53 108.35 19.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 167.653 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 88.7 t -70.55 125.74 29.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 123.727 0.811 . . . . 0.0 109.389 176.325 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 39.2 ttm180 54.64 63.83 2.01 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.108 1.363 . . . . 0.0 111.035 172.241 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -70.38 137.36 50.44 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.554 0.742 . . . . 0.0 111.476 -171.427 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -114.66 163.44 15.44 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.818 1.647 . . . . 0.0 110.62 -179.542 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 88.1 mtm-85 -52.88 -34.96 57.08 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.867 0.867 . . . . 0.0 112.858 -175.501 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 39.5 t30 -66.13 -16.42 63.94 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.857 1.663 . . . . 0.0 115.238 176.216 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -80.28 -14.1 58.66 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 120.305 1.411 . . . . 0.0 112.989 176.312 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 20.2 m -62.74 138.79 58.6 Favored 'General case' 0 CA--C 1.546 0.806 0 O-C-N 121.015 -1.053 . . . . 0.0 112.706 -177.543 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 150.74 -163.87 29.77 Favored Glycine 0 N--CA 1.472 1.059 0 C-N-CA 124.505 1.05 . . . . 0.0 113.293 -177.762 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.8 m -92.53 138.89 31.12 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.484 1.114 . . . . 0.0 111.277 -177.213 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -134.24 160.43 37.89 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.43 1.892 . . . . 0.0 111.395 178.218 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -157.24 158.13 35.59 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.864 1.266 . . . . 0.0 112.64 173.096 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 45.5 t -109.41 147.61 32.51 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.865 1.666 . . . . 0.0 111.033 -178.68 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -150.66 142.13 9.32 Favored Glycine 0 N--CA 1.471 0.997 0 N-CA-C 114.63 0.612 . . . . 0.0 114.63 179.272 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -115.82 159.25 21.73 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.14 1.376 . . . . 0.0 113.684 -173.933 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 19.9 tt -155.95 136.36 4.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 125.723 1.609 . . . . 0.0 110.568 173.848 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 18.2 m -65.81 161.31 21.25 Favored 'General case' 0 N--CA 1.475 0.787 0 O-C-N 121.282 -0.886 . . . . 0.0 113.115 179.927 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 56.6 mt -70.06 -20.6 63.22 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.731 1.012 . . . . 0.0 113.731 -177.882 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -70.37 146.09 93.87 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 124.35 1.06 . . . . 0.0 112.253 177.4 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -69.65 -16.6 38.1 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 123.296 2.664 . . . . 0.0 113.273 -179.653 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 47.5 mmtm -79.95 -0.27 34.44 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.78 1.232 . . . . 0.0 114.142 177.114 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -77.05 165.22 24.91 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 125.633 1.573 . . . . 0.0 113.78 -178.093 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 27.4 mp0 -138.59 155.83 48.0 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.902 1.681 . . . . 0.0 109.719 174.262 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 32.0 mm -60.48 137.11 23.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 124.421 1.088 . . . . 0.0 111.158 177.879 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.12 137.2 54.91 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.983 1.713 . . . . 0.0 109.54 169.585 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -113.94 153.7 28.83 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.27 1.028 . . . . 0.0 112.863 -169.424 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 80.2 p -104.44 173.31 6.36 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.655 1.582 . . . . 0.0 112.914 174.717 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.83 122.81 18.51 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.532 1.133 . . . . 0.0 110.88 174.416 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.73 151.26 45.59 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.14 0.976 . . . . 0.0 113.227 179.662 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -143.0 164.81 29.06 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.52 1.528 . . . . 0.0 112.913 -178.486 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -102.78 143.13 32.81 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.267 1.427 . . . . 0.0 112.834 -172.737 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 60.7 tp -114.79 132.13 56.57 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 126.343 1.857 . . . . 0.0 108.542 168.075 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 61.9 ttm-85 -126.01 120.22 29.72 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.284 1.433 . . . . 0.0 109.908 174.098 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 41.2 t -104.36 113.09 40.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 124.355 1.062 . . . . 0.0 108.623 170.507 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 71.2 p -93.01 145.31 24.47 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.342 1.457 . . . . 0.0 109.858 178.925 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -66.64 144.91 56.11 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 121.431 0.634 . . . . 0.0 111.959 -178.212 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 55.8 ttm-85 . . . . . 0 N--CA 1.467 0.384 0 C-N-CA 123.878 0.871 . . . . 0.0 110.337 -176.622 . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 27.5 m . . . . . 0 N--CA 1.471 0.6 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 . . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 43.9 t80 -149.01 121.39 8.45 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.677 1.191 . . . . 0.0 110.484 -176.576 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 58.7 m -140.87 159.89 60.53 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 124.489 1.115 . . . . 0.0 113.026 -169.344 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -70.02 158.85 91.37 Favored 'Cis proline' 0 C--N 1.353 0.807 0 CA-C-N 119.88 0.993 . . . . 0.0 111.482 -5.168 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.56 -30.99 69.02 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 174.476 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 33.4 tp -134.93 123.08 22.83 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 125.44 1.496 . . . . 0.0 108.932 170.403 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 54.7 tp -108.37 124.84 50.99 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.736 1.214 . . . . 0.0 109.256 170.524 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 18.8 t -109.76 124.31 66.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 C-N-CA 123.935 0.894 . . . . 0.0 108.898 173.566 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.6 m -127.64 169.83 18.43 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 C-N-CA 124.897 1.279 . . . . 0.0 111.355 171.924 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 89.5 m -100.0 147.86 25.15 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.771 1.229 . . . . 0.0 110.244 174.757 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -55.32 119.1 5.06 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.676 1.19 . . . . 0.0 112.159 179.808 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.87 -1.16 63.16 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 126.301 1.905 . . . . 0.0 114.709 -176.911 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -90.93 153.73 19.98 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 119.275 1.538 . . . . 0.0 110.924 171.245 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -80.79 139.91 35.77 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 121.875 0.845 . . . . 0.0 111.519 171.919 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -114.65 130.27 56.78 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.246 1.818 . . . . 0.0 110.545 -178.664 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 30.9 m -132.7 124.6 28.49 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.71 0.804 . . . . 0.0 111.618 -176.552 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -101.59 159.57 15.19 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.032 1.733 . . . . 0.0 110.299 169.469 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 25.9 m -112.66 132.02 55.37 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.368 1.467 . . . . 0.0 110.067 175.057 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 35.3 t -114.39 140.82 48.36 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.572 1.549 . . . . 0.0 112.08 171.899 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 17.2 m -134.13 131.85 39.19 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.967 1.707 . . . . 0.0 108.305 176.036 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 42.4 p90 . . . . . 0 N--CA 1.474 0.772 0 CA-C-N 119.919 1.236 . . . . 0.0 113.558 -169.179 . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 55.9 p90 . . . . . 0 CA--C 1.537 0.458 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 . . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 62.4 t -107.14 124.2 62.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 125.5 1.52 . . . . 0.0 107.08 167.681 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -99.4 140.78 33.07 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.454 1.502 . . . . 0.0 108.014 170.701 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 31.4 m120 -136.68 149.42 47.91 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.502 1.521 . . . . 0.0 111.171 175.331 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 22.0 t90 -124.55 138.36 54.33 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.525 1.13 . . . . 0.0 110.73 174.602 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -132.47 147.94 52.38 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 -170.939 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.9 ttt180 -109.26 141.34 41.69 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.792 1.637 . . . . 0.0 108.355 167.242 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 36.2 mtp -86.42 145.89 26.66 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 118.944 0.793 . . . . 0.0 112.462 176.301 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.1 p -88.88 165.2 28.34 Favored Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 123.89 0.876 . . . . 0.0 112.662 174.162 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -58.82 -28.98 88.65 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 123.636 2.891 . . . . 0.0 113.433 170.594 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.4 m -80.36 1.78 27.49 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.896 1.279 . . . . 0.0 113.265 175.939 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 73.61 21.09 2.92 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 127.588 2.355 . . . . 0.0 113.213 -179.649 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -88.38 -172.67 3.87 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.622 0.769 . . . . 0.0 109.575 169.483 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.3 p -140.59 142.86 35.04 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.376 1.47 . . . . 0.0 110.804 -174.84 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -122.86 131.53 53.79 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.505 1.122 . . . . 0.0 110.922 175.442 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 20.8 ttmt -71.9 137.74 47.65 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.873 0.869 . . . . 0.0 110.632 178.385 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 52.8 mt -114.61 -45.99 2.98 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.936 1.695 . . . . 0.0 111.975 -171.944 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -156.51 168.62 26.82 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 126.281 1.832 . . . . 0.0 109.689 179.683 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -156.62 163.68 39.05 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.348 1.059 . . . . 0.0 111.955 -174.801 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -149.2 110.35 3.46 Favored Pre-proline 0 CA--C 1.547 0.835 0 CA-C-O 118.024 -0.988 . . . . 0.0 110.676 174.646 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo . . . . . 0 C--N 1.352 0.734 0 CA-C-N 120.64 1.264 . . . . 0.0 113.623 -4.794 . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 44.6 mtp180 . . . . . 0 N--CA 1.472 0.66 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 . . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 -95.01 137.48 34.0 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.937 1.295 . . . . 0.0 111.079 178.43 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 30.0 ttp180 -144.46 151.61 39.43 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.234 1.014 . . . . 0.0 111.925 177.421 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -122.79 133.83 67.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 124.962 1.305 . . . . 0.0 110.753 168.869 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.1 m -130.5 130.01 43.63 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.098 1.359 . . . . 0.0 109.871 -173.247 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -79.4 136.38 36.95 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 118.736 0.698 . . . . 0.0 110.778 178.549 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 7.0 mt -79.79 159.9 70.39 Favored Pre-proline 0 CA--C 1.544 0.715 0 CA-C-O 118.92 -0.562 . . . . 0.0 111.652 177.773 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -62.85 -16.74 55.65 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 123.135 2.556 . . . . 0.0 113.646 170.996 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -66.11 -26.06 67.28 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 119.231 0.923 . . . . 0.0 112.439 169.793 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 86.21 -34.11 3.49 Favored Glycine 0 N--CA 1.472 1.066 0 C-N-CA 126.836 2.16 . . . . 0.0 114.393 169.881 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 -111.53 73.65 0.83 Allowed 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.594 1.158 . . . . 0.0 108.194 169.41 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 175.36 141.3 0.05 Allowed 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 128.388 2.675 . . . . 0.0 109.739 -170.606 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -142.33 150.22 40.48 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.453 1.101 . . . . 0.0 112.37 178.931 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 18.2 m170 -98.82 139.24 34.79 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.329 1.452 . . . . 0.0 110.229 167.003 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -115.11 113.07 23.52 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 126.761 2.024 . . . . 0.0 108.058 175.961 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 17.8 m -118.76 128.44 54.49 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 114.331 1.234 . . . . 0.0 114.331 -167.338 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 36.6 t -99.24 117.56 44.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 125.869 1.668 . . . . 0.0 106.947 167.528 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 97.2 t -83.09 126.33 40.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 123.893 0.877 . . . . 0.0 109.96 174.577 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 85.5 mtt85 54.21 66.55 1.2 Allowed 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 126.11 1.764 . . . . 0.0 111.624 176.963 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.96 136.43 53.92 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.487 1.115 . . . . 0.0 111.308 -176.87 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -118.26 165.64 13.57 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 126.9 2.08 . . . . 0.0 110.462 -178.262 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 26.3 mmm180 -52.52 -28.73 21.83 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.348 1.059 . . . . 0.0 113.054 178.231 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -63.66 -24.22 67.7 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 125.66 1.584 . . . . 0.0 114.825 173.228 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -86.08 -17.88 33.9 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 120.147 1.34 . . . . 0.0 113.682 -176.992 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 49.3 m -57.71 133.86 55.72 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 120.779 -1.2 . . . . 0.0 112.681 -178.742 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 153.39 -167.46 31.91 Favored Glycine 0 N--CA 1.473 1.152 0 C-N-CA 124.253 0.93 . . . . 0.0 113.788 -176.073 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.2 m -91.1 143.05 27.1 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 125.162 1.385 . . . . 0.0 110.825 -175.861 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -139.94 157.55 45.5 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 126.462 1.905 . . . . 0.0 111.551 -177.796 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -156.94 149.31 23.18 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.324 1.05 . . . . 0.0 113.269 173.011 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 44.3 t -89.63 152.98 21.1 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.35 1.86 . . . . 0.0 110.884 172.057 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -160.05 141.63 7.6 Favored Glycine 0 N--CA 1.47 0.936 0 O-C-N 121.469 -0.769 . . . . 0.0 113.207 170.214 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -138.13 158.59 44.01 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 118.259 1.029 . . . . 0.0 113.154 -177.419 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 16.7 tt -147.27 134.62 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 C-N-CA 125.364 1.466 . . . . 0.0 110.097 -178.951 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 65.7 m -76.17 158.48 31.65 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 121.62 -0.675 . . . . 0.0 111.795 176.994 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 28.3 mt -73.92 -10.01 59.22 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 -177.264 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.81 143.06 94.53 Favored Pre-proline 0 CA--C 1.551 1.012 0 C-N-CA 124.104 0.962 . . . . 0.0 111.816 173.738 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -67.72 -19.83 47.05 Favored 'Trans proline' 0 CA--C 1.538 0.675 0 C-N-CA 123.313 2.676 . . . . 0.0 113.35 -176.943 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 23.3 ttpp -83.7 -0.39 50.56 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 124.92 1.288 . . . . 0.0 113.572 177.459 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -74.87 149.75 39.43 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.364 1.066 . . . . 0.0 113.39 -178.277 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -128.89 158.29 39.19 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.925 2.09 . . . . 0.0 107.764 169.991 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 35.1 mt -70.94 114.9 9.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 O-C-N 121.487 -0.758 . . . . 0.0 110.43 -179.072 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -77.85 88.51 4.06 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.32 1.448 . . . . 0.0 108.792 169.629 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -78.65 133.71 37.21 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.129 0.972 . . . . 0.0 110.394 176.898 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 45.0 m -83.68 175.53 9.64 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.396 1.078 . . . . 0.0 113.225 179.669 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 84.5 mt -58.56 147.49 32.03 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.188 0.995 . . . . 0.0 111.563 171.682 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -75.51 132.29 40.65 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 123.369 0.668 . . . . 0.0 110.561 173.839 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.9 169.65 9.07 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 126.268 1.827 . . . . 0.0 109.877 170.06 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -133.98 145.09 49.19 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 122.027 0.917 . . . . 0.0 113.021 173.271 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 68.0 tp -103.66 135.11 45.85 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 127.081 2.152 . . . . 0.0 109.687 176.233 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 60.7 ttt85 -125.27 118.09 25.22 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.731 1.612 . . . . 0.0 109.858 172.425 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 53.2 t -98.4 118.81 45.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 C-N-CA 124.062 0.945 . . . . 0.0 108.573 169.057 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 81.7 p -91.53 149.81 21.5 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.411 1.485 . . . . 0.0 109.999 173.438 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -63.16 147.09 51.87 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.276 0.56 . . . . 0.0 112.035 -179.028 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 27.5 ttm180 . . . . . 0 C--O 1.237 0.402 0 C-N-CA 123.805 0.842 . . . . 0.0 109.93 -176.072 . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 32.1 p . . . . . 0 N--CA 1.479 1.008 0 CA-C-O 120.119 0.009 . . . . 0.0 110.994 . . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -121.86 135.67 54.9 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.004 1.322 . . . . 0.0 110.557 175.328 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 95.1 p -140.98 159.04 63.48 Favored Pre-proline 0 CA--C 1.549 0.921 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 173.31 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -72.7 163.72 88.0 Favored 'Cis proline' 0 C--N 1.352 0.737 0 CA-C-N 119.186 0.745 . . . . 0.0 111.411 -11.376 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.7 -33.9 74.82 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 170.432 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 51.7 tp -138.93 123.57 18.53 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.594 1.557 . . . . 0.0 109.269 171.563 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 51.6 tp -105.14 130.78 53.23 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.259 1.424 . . . . 0.0 109.341 170.755 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.4 t -112.06 126.55 69.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.987 0.915 . . . . 0.0 108.658 170.607 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.3 m -129.56 165.98 28.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 124.545 1.138 . . . . 0.0 111.933 173.079 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 20.0 m -86.3 146.5 26.48 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.178 0.991 . . . . 0.0 110.138 169.573 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 58.1 tt0 -55.32 123.59 14.3 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.042 1.337 . . . . 0.0 110.799 173.02 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.0 -0.5 72.77 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 125.5 1.524 . . . . 0.0 114.861 -174.334 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -95.43 158.08 15.61 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 119.644 1.722 . . . . 0.0 112.274 174.522 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 -83.11 116.58 22.39 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.073 0.949 . . . . 0.0 110.747 -179.866 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -98.47 116.12 30.01 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.292 1.037 . . . . 0.0 111.147 -179.793 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 57.1 m -125.28 125.45 43.55 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 118.718 0.69 . . . . 0.0 111.896 -174.609 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -101.06 146.72 27.07 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 126.371 1.868 . . . . 0.0 110.689 171.989 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 31.5 m -93.95 129.34 40.45 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.042 1.337 . . . . 0.0 108.813 171.199 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 69.8 m -130.3 130.24 44.25 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.398 1.079 . . . . 0.0 110.654 172.252 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 68.5 m -117.44 143.4 46.05 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.339 1.456 . . . . 0.0 110.687 -176.316 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 . . . . . 0 N--CA 1.468 0.446 0 C-N-CA 125.248 1.419 . . . . 0.0 113.475 -172.841 . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 50.3 p90 . . . . . 0 CA--C 1.54 0.559 0 CA-C-O 120.477 0.179 . . . . 0.0 111.461 . . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 77.4 t -95.93 127.98 47.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 172.263 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 61.3 tp -106.54 136.16 46.79 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 125.217 1.407 . . . . 0.0 109.751 173.618 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -132.43 153.8 50.48 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.282 1.833 . . . . 0.0 110.528 179.151 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 15.0 t90 -123.52 139.82 53.63 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.659 1.184 . . . . 0.0 111.118 176.081 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 64.4 m-85 -134.28 143.7 47.91 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 114.516 1.302 . . . . 0.0 114.516 -170.824 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 56.9 ttt85 -102.19 143.01 32.53 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.575 1.55 . . . . 0.0 109.229 168.406 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 86.3 mmm -77.46 133.04 38.71 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 118.466 0.575 . . . . 0.0 111.463 174.319 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.5 p -82.45 166.22 37.73 Favored Pre-proline 0 CA--C 1.549 0.914 0 O-C-N 121.557 -0.715 . . . . 0.0 112.555 173.669 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -58.32 -27.99 83.08 Favored 'Trans proline' 0 C--N 1.354 0.856 0 C-N-CA 123.475 2.784 . . . . 0.0 113.662 170.267 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 31.3 m -83.92 2.94 36.21 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.985 1.314 . . . . 0.0 113.189 175.424 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 69.55 26.68 5.02 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 126.721 2.008 . . . . 0.0 112.639 -178.758 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -92.23 -177.47 4.67 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.083 0.953 . . . . 0.0 109.743 169.606 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 8.7 p -127.48 122.51 33.64 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.574 1.55 . . . . 0.0 109.582 -171.981 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -108.22 126.35 52.7 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 124.288 1.035 . . . . 0.0 110.976 -178.094 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -79.22 120.53 23.84 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.632 1.173 . . . . 0.0 111.98 -170.809 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 42.4 mt -97.88 -49.38 4.82 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.654 1.582 . . . . 0.0 111.991 -170.139 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -162.56 169.17 20.68 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.438 1.895 . . . . 0.0 110.145 -173.12 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -157.22 162.65 39.27 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.451 1.101 . . . . 0.0 112.928 -170.155 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -152.32 113.5 2.85 Favored Pre-proline 0 CA--C 1.552 1.038 0 C-N-CA 125.379 1.472 . . . . 0.0 111.114 174.547 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo . . . . . 0 CA--C 1.538 0.686 0 CA-C-N 119.653 0.912 . . . . 0.0 110.287 -12.041 . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 60.6 mtm-85 . . . . . 0 N--CA 1.471 0.608 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 . . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 84.4 m-85 -69.48 130.68 43.16 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.473 1.509 . . . . 0.0 112.026 -179.045 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 31.8 ttp-105 -144.39 141.29 29.57 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 126.041 1.737 . . . . 0.0 111.079 -176.841 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 57.9 t -108.46 127.81 64.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 C-N-CA 125.089 1.356 . . . . 0.0 108.678 169.502 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 6.0 m -123.32 138.65 54.57 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.633 1.573 . . . . 0.0 109.428 -176.323 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.16 141.79 34.44 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.108 0.963 . . . . 0.0 112.679 179.373 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -96.76 158.72 33.08 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 126.079 1.752 . . . . 0.0 111.169 -174.75 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -66.98 -11.28 31.64 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 123.627 2.884 . . . . 0.0 114.224 -178.993 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -66.56 -18.25 65.26 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 119.197 0.908 . . . . 0.0 113.248 172.203 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 88.83 -14.69 59.57 Favored Glycine 0 CA--C 1.535 1.3 0 C-N-CA 125.496 1.522 . . . . 0.0 115.323 175.492 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.4 ptp180 -154.51 73.53 0.91 Allowed 'General case' 0 N--CA 1.473 0.694 0 CA-C-O 122.972 1.367 . . . . 0.0 110.581 171.585 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -165.04 143.87 6.59 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 129.254 3.022 . . . . 0.0 106.684 -179.657 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -145.32 145.2 31.13 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -167.54 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 7.3 m-70 -109.1 117.6 34.58 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.539 1.536 . . . . 0.0 110.859 170.118 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -100.47 111.16 23.38 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 125.768 1.627 . . . . 0.0 108.206 177.855 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 13.6 t -120.12 130.09 54.46 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 -168.061 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 12.1 t -97.45 100.25 10.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 125.696 1.598 . . . . 0.0 107.045 168.444 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 95.4 t -66.83 130.8 32.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 123.662 0.785 . . . . 0.0 109.907 178.191 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . 0.265 14.6 ptm180 39.7 61.16 1.48 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 127.516 2.326 . . . . 0.0 113.94 -177.123 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.76 140.01 57.71 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.403 1.481 . . . . 0.0 112.605 -171.731 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -104.61 162.02 13.63 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.355 1.462 . . . . 0.0 110.866 -179.478 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 16.4 mmm180 -47.48 -41.12 20.0 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.471 1.108 . . . . 0.0 113.015 178.043 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -65.27 -21.56 66.74 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 125.349 1.46 . . . . 0.0 114.832 177.657 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -75.8 -12.24 60.13 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 119.133 0.879 . . . . 0.0 112.532 176.993 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.5 m -59.09 139.53 56.78 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 120.634 -1.291 . . . . 0.0 111.609 171.794 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 154.76 -168.28 32.79 Favored Glycine 0 N--CA 1.468 0.771 0 C-N-CA 123.927 0.775 . . . . 0.0 113.313 179.428 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.1 m -95.5 144.23 26.16 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.934 1.294 . . . . 0.0 110.191 -179.115 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 -142.82 162.95 34.11 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.605 1.562 . . . . 0.0 112.488 -175.143 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.1 pp -153.48 148.39 26.57 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.845 1.258 . . . . 0.0 111.984 169.154 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 71.0 m -90.24 153.1 20.74 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.701 1.2 . . . . 0.0 109.652 169.383 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -152.95 134.1 4.31 Favored Glycine 0 N--CA 1.471 1.026 0 O-C-N 121.225 -0.922 . . . . 0.0 113.373 176.45 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -119.75 157.57 28.32 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.347 1.059 . . . . 0.0 112.417 -178.856 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.0 tt -151.41 132.17 4.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 124.868 1.267 . . . . 0.0 110.77 177.939 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 44.9 t -65.21 157.82 27.81 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.894 0.877 . . . . 0.0 112.819 178.251 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 3.8 pp -71.51 -9.48 58.27 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 175.024 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -66.5 146.09 99.02 Favored Pre-proline 0 CA--C 1.552 1.023 0 C-N-CA 124.318 1.047 . . . . 0.0 112.057 175.948 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -68.75 -24.6 34.49 Favored 'Trans proline' 0 CA--C 1.539 0.736 0 C-N-CA 123.092 2.528 . . . . 0.0 113.023 -178.746 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.6 ptmt -83.16 1.37 40.87 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 177.827 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.04 163.75 21.66 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.525 1.13 . . . . 0.0 113.751 -174.837 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 22.3 pt20 -149.68 163.07 38.94 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.53 1.932 . . . . 0.0 109.31 175.32 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 67.1 mt -73.13 119.27 19.74 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 CA-C-O 121.799 0.809 . . . . 0.0 111.174 -173.65 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 25.2 ttmt -88.08 124.73 34.07 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 126.857 2.063 . . . . 0.0 109.536 169.688 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -147.72 158.72 44.15 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.266 1.426 . . . . 0.0 111.292 -179.036 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 17.9 m -117.46 -173.54 2.44 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.674 1.59 . . . . 0.0 111.913 179.855 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 98.5 mt -60.02 143.25 52.33 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.125 0.97 . . . . 0.0 111.836 176.533 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 91.8 mtm-85 -66.52 153.35 43.17 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.91 1.284 . . . . 0.0 113.388 -172.619 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.89 162.56 17.15 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.567 1.947 . . . . 0.0 110.811 175.675 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -130.16 142.74 50.56 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.604 1.162 . . . . 0.0 111.618 -177.2 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 50.9 tp -116.09 133.89 55.54 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 125.978 1.711 . . . . 0.0 110.082 173.41 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 43.5 ttm180 -122.36 117.17 25.41 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.881 1.673 . . . . 0.0 109.31 170.427 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 54.4 t -99.99 119.21 47.74 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 N-CA-C 107.861 -1.162 . . . . 0.0 107.861 169.962 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 72.6 p -98.68 139.9 33.7 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.31 1.444 . . . . 0.0 109.422 177.614 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 4.5 pm0 -62.98 146.04 54.02 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.672 0.789 . . . . 0.0 113.119 -173.041 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 42.9 ttt85 . . . . . 0 C--O 1.235 0.341 0 C-N-CA 124.132 0.973 . . . . 0.0 110.338 -170.179 . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.8 t . . . . . 0 N--CA 1.473 0.719 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 . . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -146.82 118.0 7.81 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.642 1.977 . . . . 0.0 110.007 179.332 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 90.2 p -140.91 163.23 43.92 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 125.027 1.331 . . . . 0.0 113.5 -171.114 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -70.87 165.5 79.6 Favored 'Cis proline' 0 C--N 1.353 0.803 0 CA-C-N 119.932 1.011 . . . . 0.0 111.818 -7.945 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.64 -29.52 70.74 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 172.785 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 51.8 tp -141.31 124.63 16.55 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.65 1.58 . . . . 0.0 109.205 172.356 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 61.3 tp -109.53 126.02 53.12 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.489 1.516 . . . . 0.0 109.012 170.685 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.2 t -110.25 125.14 67.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 123.921 0.888 . . . . 0.0 108.784 173.359 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 33.5 m -130.39 162.8 37.62 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.075 0 C-N-CA 124.667 1.187 . . . . 0.0 112.091 174.053 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 16.5 m -88.36 147.48 24.73 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.533 1.133 . . . . 0.0 110.478 171.874 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -58.61 121.56 11.3 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.884 0.874 . . . . 0.0 112.117 -179.514 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 98.98 -2.94 58.34 Favored Glycine 0 CA--C 1.533 1.162 0 C-N-CA 125.844 1.688 . . . . 0.0 114.54 -173.903 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -87.65 158.16 18.92 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 119.743 1.772 . . . . 0.0 112.443 177.314 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -77.48 116.04 17.74 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.429 1.092 . . . . 0.0 110.492 170.633 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -102.63 119.62 39.14 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.993 0.917 . . . . 0.0 110.439 178.528 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 54.1 m -128.84 125.37 37.56 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 119.052 0.842 . . . . 0.0 111.711 -175.996 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -98.09 155.69 17.01 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.068 1.747 . . . . 0.0 110.253 169.826 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 56.5 m -107.97 125.7 51.83 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.094 1.358 . . . . 0.0 109.476 177.344 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 16.6 t -118.37 151.64 37.36 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.825 1.25 . . . . 0.0 111.265 170.458 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 24.8 t -147.94 133.28 18.53 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.161 -0.962 . . . . 0.0 111.76 174.186 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 33.2 m-85 . . . . . 0 N--CA 1.468 0.457 0 C-N-CA 127.699 2.399 . . . . 0.0 110.083 170.369 . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 24.3 p90 . . . . . 0 CA--C 1.536 0.433 0 N-CA-C 113.959 1.096 . . . . 0.0 113.959 . . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 57.3 t -106.37 135.5 44.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 C-N-CA 126.432 1.893 . . . . 0.0 107.662 169.595 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 20.9 tp -104.57 135.96 45.01 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.639 0.775 . . . . 0.0 110.59 171.656 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -127.92 156.06 43.21 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.293 1.437 . . . . 0.0 111.577 -170.035 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 16.2 t90 -129.39 136.03 49.45 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.778 1.231 . . . . 0.0 111.69 -179.607 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -135.84 145.89 46.9 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.399 1.08 . . . . 0.0 112.815 -176.726 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.8 ttt-85 -103.39 141.78 35.36 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.328 1.451 . . . . 0.0 108.85 168.883 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 31.5 mtp -90.29 145.36 25.04 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 118.747 0.703 . . . . 0.0 112.113 178.15 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 70.8 m -95.81 154.86 38.96 Favored Pre-proline 0 CA--C 1.546 0.82 0 C-N-CA 125.175 1.39 . . . . 0.0 111.182 173.526 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -65.44 -23.4 58.2 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 123.175 2.584 . . . . 0.0 113.088 179.435 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 14.6 m -76.96 9.38 2.97 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.087 1.355 . . . . 0.0 113.534 172.398 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . 0.323 0.0 OUTLIER 70.95 20.84 5.19 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 128.891 2.876 . . . . 0.0 114.555 179.545 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -93.66 -174.31 3.43 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.766 1.226 . . . . 0.0 110.949 170.605 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.5 p -144.15 152.56 41.07 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 126.382 1.873 . . . . 0.0 110.317 -175.546 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -128.68 133.15 48.12 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.436 1.094 . . . . 0.0 111.083 172.937 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -78.07 128.3 33.63 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.834 0.854 . . . . 0.0 111.173 -179.95 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 61.4 mt -100.25 -51.02 3.77 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.819 1.248 . . . . 0.0 111.414 -170.342 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -171.09 173.33 5.07 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.582 1.953 . . . . 0.0 110.483 -176.663 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -158.63 161.64 37.2 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.3 1.44 . . . . 0.0 112.077 -176.977 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -141.23 125.5 10.38 Favored Pre-proline 0 CA--C 1.548 0.889 0 C-N-CA 125.148 1.379 . . . . 0.0 110.192 172.549 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo . . . . . 0 C--N 1.351 0.661 0 CA-C-N 120.257 1.128 . . . . 0.0 113.144 -9.025 . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 8.8 ptp180 . . . . . 0 N--CA 1.469 0.496 0 N-CA-C 113.666 0.988 . . . . 0.0 113.666 . . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -93.35 135.62 34.39 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.165 0.986 . . . . 0.0 111.634 -179.349 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 52.6 mtm180 -139.96 153.12 46.82 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.776 1.23 . . . . 0.0 112.255 177.937 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 63.6 t -126.5 125.55 67.48 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 125.265 1.426 . . . . 0.0 108.094 168.139 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 87.2 m -130.43 126.62 37.46 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.249 1.02 . . . . 0.0 110.235 -178.414 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -80.89 139.87 35.66 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.654 0.781 . . . . 0.0 110.748 174.369 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 16.3 mt -80.85 158.46 70.44 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 124.078 0.951 . . . . 0.0 111.585 177.117 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -65.08 -4.21 8.6 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 123.429 2.752 . . . . 0.0 114.99 179.142 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -70.59 -25.97 63.3 Favored 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 120.562 1.528 . . . . 0.0 112.467 169.908 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 96.58 -3.94 63.6 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 126.214 1.864 . . . . 0.0 114.628 173.701 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 31.2 ptt180 -154.62 73.71 0.91 Allowed 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.937 1.695 . . . . 0.0 110.501 176.17 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -178.02 143.02 0.3 Allowed 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 128.951 2.9 . . . . 0.0 107.905 179.389 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -146.46 136.83 23.82 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.489 0.661 . . . . 0.0 112.757 -168.693 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -98.73 125.55 44.08 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.257 1.423 . . . . 0.0 111.615 170.066 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -104.23 103.24 12.98 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 127.172 2.189 . . . . 0.0 108.39 175.184 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 54.5 p -117.12 132.63 56.62 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 114.842 1.423 . . . . 0.0 114.842 -169.491 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 12.3 t -96.36 111.31 26.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 126.109 1.763 . . . . 0.0 106.961 167.312 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 94.3 t -78.38 127.94 38.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 124.785 1.234 . . . . 0.0 109.302 175.061 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 13.8 tpt180 57.79 54.53 6.14 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.874 1.27 . . . . 0.0 111.092 174.882 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.47 136.85 58.1 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.226 -0.921 . . . . 0.0 113.171 -168.723 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 45.4 mmm-85 -111.38 160.53 16.98 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 125.553 1.541 . . . . 0.0 111.021 -179.248 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 77.3 mtm180 -55.84 -22.59 25.8 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 113.515 0.932 . . . . 0.0 113.515 172.323 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -56.72 -35.51 68.64 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.754 1.621 . . . . 0.0 113.654 168.322 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -83.89 -23.3 31.31 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.862 0.865 . . . . 0.0 112.99 -168.595 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 48.8 m -49.69 139.29 13.03 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.789 1.236 . . . . 0.0 113.119 177.417 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 148.13 -165.87 28.96 Favored Glycine 0 N--CA 1.472 1.033 0 C-N-CA 124.326 0.965 . . . . 0.0 113.359 -176.287 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.2 m -92.35 142.69 27.17 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.982 1.313 . . . . 0.0 110.533 -178.093 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 45.1 m-85 -135.5 161.16 36.27 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.848 1.659 . . . . 0.0 111.91 -179.299 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -148.95 153.28 37.74 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.747 1.219 . . . . 0.0 112.245 172.927 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 49.6 t -101.32 155.4 18.06 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.648 1.579 . . . . 0.0 110.221 169.85 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -163.29 133.6 3.11 Favored Glycine 0 N--CA 1.471 0.999 0 N-CA-C 115.345 0.898 . . . . 0.0 115.345 174.587 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -94.97 157.3 15.96 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.47 1.108 . . . . 0.0 112.76 179.793 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 18.9 tt -152.59 135.41 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 125.065 1.346 . . . . 0.0 110.184 174.673 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 69.7 p -75.53 161.57 29.06 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.68 0.792 . . . . 0.0 113.002 178.2 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.51 -3.39 8.49 Favored 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 115.51 1.67 . . . . 0.0 115.51 178.709 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -73.84 144.18 82.4 Favored Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 124.468 1.107 . . . . 0.0 112.652 -176.306 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -56.53 -32.86 91.14 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 123.362 2.708 . . . . 0.0 113.754 172.502 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.09 4.34 34.61 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 115.046 1.499 . . . . 0.0 115.046 -179.604 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.31 160.32 24.78 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.324 1.05 . . . . 0.0 113.789 -173.833 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -145.34 162.82 36.32 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.821 1.649 . . . . 0.0 110.124 175.017 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 57.8 mt -80.68 119.2 29.78 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 123.62 0.768 . . . . 0.0 111.429 -169.973 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -82.37 93.33 7.16 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.398 1.479 . . . . 0.0 108.303 168.605 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 60.2 mt-10 -79.37 144.49 34.12 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.652 0.781 . . . . 0.0 112.743 -174.658 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 50.2 m -87.37 169.28 12.4 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.814 1.245 . . . . 0.0 113.277 169.776 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 94.2 mt -65.65 150.62 48.16 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.574 0.75 . . . . 0.0 109.888 168.003 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? -76.77 148.23 36.79 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.42 0.688 . . . . 0.0 112.373 -172.531 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -117.95 166.35 12.61 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.429 1.891 . . . . 0.0 110.596 170.093 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -126.36 139.02 53.61 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.656 1.182 . . . . 0.0 111.061 176.84 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 63.7 tp -106.8 131.37 53.99 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.45 1.5 . . . . 0.0 109.531 169.82 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -121.7 109.54 14.85 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.322 1.449 . . . . 0.0 109.199 170.302 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 24.1 t -95.95 114.36 32.48 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 169.979 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 68.9 p -95.73 146.14 24.75 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.452 1.501 . . . . 0.0 109.612 -179.787 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -63.15 148.34 48.26 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 121.627 0.727 . . . . 0.0 112.539 -175.968 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 34.2 ttm180 . . . . . 0 C--O 1.235 0.34 0 C-N-CA 124.156 0.982 . . . . 0.0 110.02 -175.551 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . 0.251 66.9 ttp . . . . . 0 N--CA 1.488 1.431 0 CA-C-O 116.594 -1.67 . . . . 0.0 112.595 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -73.36 148.56 43.53 Favored 'Trans proline' 0 CA--C 1.543 0.973 0 CA-C-N 122.548 1.946 . . . . 0.0 112.159 -176.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -74.25 115.08 4.2 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 123.814 3.009 . . . . 0.0 109.333 173.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 48.4 m -121.46 150.63 41.27 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.046 1.338 . . . . 0.0 110.063 -169.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -147.0 119.71 8.59 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.894 1.677 . . . . 0.0 109.385 178.026 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 88.3 p -140.85 159.13 63.47 Favored Pre-proline 0 CA--C 1.548 0.904 0 N-CA-C 113.831 1.048 . . . . 0.0 113.831 -168.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -70.06 160.75 88.38 Favored 'Cis proline' 0 C--N 1.355 0.893 0 CA-C-N 119.33 0.796 . . . . 0.0 111.513 -5.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.38 -20.52 66.42 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 176.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 36.5 tp -141.45 116.89 10.18 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 125.43 1.492 . . . . 0.0 108.819 169.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 61.2 tp -104.71 121.81 44.37 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.282 1.433 . . . . 0.0 108.856 170.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 24.0 t -110.67 122.08 64.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 124.251 1.02 . . . . 0.0 108.311 174.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 27.8 m -133.01 167.67 26.1 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 C-N-CA 124.849 1.26 . . . . 0.0 111.777 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.3 m -93.7 150.97 19.97 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.0 1.32 . . . . 0.0 110.66 174.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -46.5 125.67 7.24 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.71 1.204 . . . . 0.0 111.703 168.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.96 -1.11 82.93 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 125.906 1.717 . . . . 0.0 114.813 -179.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -74.67 151.82 39.22 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 119.801 1.801 . . . . 0.0 112.65 173.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 68.0 m-20 -86.64 88.19 7.61 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.2 1.0 . . . . 0.0 109.188 171.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -77.08 114.42 15.86 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.723 0.809 . . . . 0.0 112.351 -167.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 53.0 m -116.27 130.58 56.85 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -171.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -108.57 159.6 16.58 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 127.056 2.142 . . . . 0.0 110.027 168.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 87.9 m -112.97 126.34 55.38 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.375 1.07 . . . . 0.0 110.542 175.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 29.9 m -98.31 148.88 23.2 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.152 0.981 . . . . 0.0 110.215 167.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 39.3 t -139.06 127.4 22.81 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.327 1.051 . . . . 0.0 109.443 172.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -134.45 146.27 49.64 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.861 1.264 . . . . 0.0 112.411 -173.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.2 m -128.14 134.49 49.1 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.572 1.549 . . . . 0.0 109.369 172.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -145.01 147.18 32.34 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.816 1.246 . . . . 0.0 111.192 -172.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 18.3 p -73.47 -39.85 64.58 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.975 1.31 . . . . 0.0 111.306 171.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 17.0 m -60.01 127.95 34.43 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.268 1.827 . . . . 0.0 111.994 173.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -65.21 -28.06 69.12 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.374 1.47 . . . . 0.0 112.864 -178.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 67.9 m -138.76 149.33 44.9 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.789 1.636 . . . . 0.0 110.738 176.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 52.4 p90 -163.4 162.94 25.14 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.055 1.342 . . . . 0.0 111.836 -173.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 45.6 t -95.9 132.89 38.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 125.326 1.45 . . . . 0.0 107.765 169.098 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 10.7 tp -99.41 142.43 30.9 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.418 1.487 . . . . 0.0 108.008 168.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -145.56 158.97 43.77 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.409 1.084 . . . . 0.0 113.191 -176.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 16.1 t90 -134.43 141.04 46.68 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.438 1.095 . . . . 0.0 112.512 -170.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -136.92 147.99 46.73 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -172.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 55.5 ttt85 -99.78 129.99 45.94 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 166.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 24.7 tpp -98.49 127.31 44.37 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.258 1.823 . . . . 0.0 109.382 179.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 44.9 m -90.84 160.59 37.91 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 125.469 1.508 . . . . 0.0 113.052 -174.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -67.44 -18.7 49.53 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 123.263 2.642 . . . . 0.0 112.827 173.024 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 42.5 p -76.92 -3.78 40.5 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.657 1.583 . . . . 0.0 113.367 169.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 32.0 m-80 73.77 20.8 2.88 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 128.287 2.635 . . . . 0.0 113.464 179.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.3 pp0? -97.75 169.59 9.57 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.818 0.847 . . . . 0.0 111.497 169.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.6 p -130.16 137.34 50.06 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.181 1.393 . . . . 0.0 110.395 -176.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -118.65 131.53 56.17 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.825 1.25 . . . . 0.0 111.219 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 76.9 tttt -75.93 132.44 40.26 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.73 1.212 . . . . 0.0 111.323 -175.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 76.1 mt -111.48 -47.14 3.2 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.689 1.196 . . . . 0.0 112.435 -170.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -167.74 169.72 11.48 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.607 1.563 . . . . 0.0 110.938 -175.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -158.72 159.39 35.19 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.078 1.351 . . . . 0.0 112.501 -177.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -145.78 118.26 5.15 Favored Pre-proline 0 CA--C 1.548 0.9 0 C-N-CA 125.676 1.591 . . . . 0.0 110.866 175.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -52.98 159.12 11.1 Favored 'Cis proline' 0 C--N 1.351 0.676 0 CA-C-N 119.997 1.035 . . . . 0.0 112.592 -12.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -68.32 94.55 0.54 Allowed 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 122.561 1.172 . . . . 0.0 112.937 -171.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -94.64 10.44 34.84 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 127.298 2.239 . . . . 0.0 112.209 173.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.24 -14.48 60.79 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.864 1.666 . . . . 0.0 114.435 177.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 33.0 t 70.02 -60.96 0.47 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 127.764 2.426 . . . . 0.0 115.291 169.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.2 mm-40 -108.01 155.06 40.72 Favored Pre-proline 0 CA--C 1.543 0.681 0 C-N-CA 124.59 1.156 . . . . 0.0 113.121 -168.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -75.78 1.28 8.27 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 124.03 3.153 . . . . 0.0 113.786 175.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -89.96 -1.74 75.93 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 125.505 1.526 . . . . 0.0 113.707 178.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 37.8 tp60 -68.48 134.38 50.02 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.053 0.941 . . . . 0.0 109.861 173.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 53.3 t0 -68.72 108.2 3.3 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 123.856 0.862 . . . . 0.0 111.595 177.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 21.0 m -65.78 -11.99 50.43 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 115.116 1.525 . . . . 0.0 115.116 -172.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 41.0 mtm180 -58.17 -41.87 84.79 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.491 1.116 . . . . 0.0 112.82 174.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -67.61 111.28 4.09 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.397 1.079 . . . . 0.0 110.038 171.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 44.3 ttp85 -120.5 139.8 52.36 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.351 1.86 . . . . 0.0 111.436 -173.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 8.6 t -109.82 131.23 61.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 125.021 1.328 . . . . 0.0 108.845 168.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 73.7 m -130.12 135.73 48.53 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.326 1.05 . . . . 0.0 109.731 172.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -92.7 126.97 38.02 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.047 1.339 . . . . 0.0 109.464 -176.025 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 86.6 mt -90.66 151.48 43.94 Favored Pre-proline 0 N--CA 1.472 0.662 0 C-N-CA 123.837 0.855 . . . . 0.0 112.968 -174.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -64.62 -2.41 5.18 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 123.783 2.989 . . . . 0.0 114.058 176.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -64.92 -25.97 68.11 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 119.572 1.078 . . . . 0.0 112.648 169.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 95.57 -34.09 5.08 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 126.209 1.861 . . . . 0.0 114.016 176.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 46.2 mtm105 -138.32 73.64 1.45 Allowed 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.117 1.367 . . . . 0.0 109.615 169.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -165.11 140.38 5.26 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 127.77 2.428 . . . . 0.0 107.132 177.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -143.7 134.85 25.68 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 -167.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.4 t-160 -96.16 113.41 25.01 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 127.452 2.301 . . . . 0.0 110.341 -177.094 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 24.9 mmt -107.7 105.64 15.59 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.875 1.67 . . . . 0.0 109.782 179.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 8.2 t -116.48 125.27 51.72 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -169.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 21.4 t -87.93 88.8 2.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 N-CA-C 106.036 -1.838 . . . . 0.0 106.036 167.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 87.7 t -65.79 119.37 10.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 178.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 62.6 72.29 0.5 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.804 1.641 . . . . 0.0 111.308 -177.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -80.39 139.2 36.63 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.31 1.044 . . . . 0.0 112.088 178.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -112.07 170.05 8.42 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.976 1.71 . . . . 0.0 109.847 175.122 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 27.7 mtp180 -56.23 -34.98 66.84 Favored 'General case' 0 N--CA 1.48 1.066 0 O-C-N 120.86 -1.15 . . . . 0.0 113.436 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 23.7 p30 -63.96 -18.72 64.55 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 115.161 1.541 . . . . 0.0 115.161 175.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -80.56 -7.35 59.21 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.071 0.948 . . . . 0.0 112.656 174.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.4 m -61.85 134.89 57.27 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.086 -1.634 . . . . 0.0 111.11 171.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 159.96 -169.2 35.85 Favored Glycine 0 N--CA 1.471 0.979 0 C-N-CA 124.334 0.969 . . . . 0.0 113.315 -177.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 7.7 m -91.84 142.71 27.28 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.349 1.06 . . . . 0.0 110.319 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -138.98 155.82 47.71 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.539 1.536 . . . . 0.0 111.967 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -159.55 154.56 24.9 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.188 1.395 . . . . 0.0 112.877 178.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 3.3 t -107.91 167.01 10.28 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.091 1.756 . . . . 0.0 111.342 -173.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -159.76 168.79 35.63 Favored Glycine 0 CA--C 1.527 0.818 0 O-C-N 121.196 -0.94 . . . . 0.0 114.208 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -143.9 155.59 44.14 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.954 1.302 . . . . 0.0 112.152 174.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.8 tt -155.68 138.05 6.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 125.652 1.581 . . . . 0.0 110.888 178.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 4.8 m -64.51 161.52 17.14 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.458 1.103 . . . . 0.0 113.067 179.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 43.6 mt -74.24 -16.79 60.94 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 -178.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -69.37 150.11 97.16 Favored Pre-proline 0 CA--C 1.552 1.027 0 C-N-CA 124.619 1.167 . . . . 0.0 112.642 178.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.59 -20.93 35.01 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 123.106 2.537 . . . . 0.0 113.1 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -82.93 0.84 42.53 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 124.784 1.234 . . . . 0.0 113.964 178.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.68 168.52 13.0 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.167 1.387 . . . . 0.0 113.83 -176.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -147.28 156.29 42.8 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.859 1.663 . . . . 0.0 110.038 175.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 52.8 mt -81.57 127.03 39.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 123.082 0.553 . . . . 0.0 111.303 -171.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -95.09 114.49 26.3 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.251 1.82 . . . . 0.0 108.17 168.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -94.52 150.43 20.26 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.46 1.104 . . . . 0.0 111.866 -176.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 60.2 p -85.59 176.64 8.08 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.777 0.831 . . . . 0.0 112.498 169.05 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -69.7 159.88 32.68 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 121.676 -0.64 . . . . 0.0 109.988 165.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -93.44 159.85 15.07 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 -176.2 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -140.65 163.87 31.72 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.412 1.885 . . . . 0.0 111.827 178.161 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -105.28 138.88 40.78 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.105 1.362 . . . . 0.0 112.199 177.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 42.7 tp -108.52 131.37 54.9 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 126.343 1.857 . . . . 0.0 107.652 167.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 30.4 ttm180 -133.78 113.23 12.07 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 124.456 1.102 . . . . 0.0 109.532 -177.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 30.8 t -107.08 112.81 41.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 C-N-CA 124.394 1.078 . . . . 0.0 109.301 -175.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 72.7 p -93.44 160.43 14.81 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 126.622 1.969 . . . . 0.0 111.177 -176.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -62.5 142.91 57.71 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.857 0.863 . . . . 0.0 113.226 -172.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -65.22 116.71 6.86 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.473 1.109 . . . . 0.0 108.747 176.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 36.8 ptt180 -66.73 156.51 35.18 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.332 0.864 . . . . 0.0 113.332 -173.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -79.21 145.41 33.63 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 123.852 0.861 . . . . 0.0 111.001 169.317 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 60.5 mt-10 . . . . . 0 C--O 1.254 1.336 0 C-N-CA 125.921 1.688 . . . . 0.0 112.395 -177.033 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 78.6 mmm . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 116.043 -1.932 . . . . 0.0 113.084 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_exo -53.67 155.17 14.27 Favored 'Trans proline' 0 C--N 1.358 1.027 0 C-N-CA 122.903 2.402 . . . . 0.0 112.675 172.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -67.35 109.2 1.73 Allowed 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 123.478 2.785 . . . . 0.0 110.357 -175.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 58.7 m -130.76 148.16 52.51 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.098 1.359 . . . . 0.0 110.504 -169.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 93.9 t80 -140.37 116.95 10.83 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 126.972 2.109 . . . . 0.0 108.214 174.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 38.1 m -140.83 160.95 56.64 Favored Pre-proline 0 N--CA 1.479 0.983 0 C-N-CA 124.545 1.138 . . . . 0.0 113.494 -168.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -68.53 156.88 88.86 Favored 'Cis proline' 0 C--N 1.355 0.897 0 CA-C-N 119.982 1.029 . . . . 0.0 111.751 -2.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.33 -28.07 64.72 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.802 0.841 . . . . 0.0 113.074 175.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -134.96 118.13 16.53 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 126.224 1.81 . . . . 0.0 109.187 173.157 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 51.7 tp -109.1 122.3 47.0 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.963 0.905 . . . . 0.0 109.761 171.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 32.2 t -106.84 122.92 61.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 124.132 0.973 . . . . 0.0 109.269 175.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.0 m -128.98 172.34 15.5 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 C-N-CA 125.04 1.336 . . . . 0.0 112.036 170.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 31.9 m -99.14 151.82 20.56 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.812 1.645 . . . . 0.0 110.693 177.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -47.19 122.07 4.25 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.998 1.319 . . . . 0.0 112.013 169.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 85.79 -1.85 87.95 Favored Glycine 0 CA--C 1.532 1.123 0 C-N-CA 125.736 1.636 . . . . 0.0 114.576 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 39.4 t0 -87.09 157.41 19.41 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.245 1.523 . . . . 0.0 111.393 175.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -84.08 150.62 25.45 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 121.903 0.859 . . . . 0.0 111.302 169.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -132.41 131.25 41.6 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.267 1.827 . . . . 0.0 110.03 -175.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 89.8 m -131.58 127.05 36.33 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.286 0.948 . . . . 0.0 111.82 179.167 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -100.11 159.54 15.02 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.002 1.721 . . . . 0.0 110.516 169.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 58.8 m -110.32 132.5 54.12 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.661 1.584 . . . . 0.0 109.88 174.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 39.5 t -116.73 144.1 44.86 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.991 1.716 . . . . 0.0 112.003 173.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 80.9 p -151.41 140.51 21.18 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.713 0.805 . . . . 0.0 112.115 171.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -131.09 156.15 45.71 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.49 1.916 . . . . 0.0 112.754 -174.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 26.5 t -93.96 130.15 40.17 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.072 0.949 . . . . 0.0 109.09 167.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -144.15 156.55 44.37 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.991 1.316 . . . . 0.0 110.828 -174.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.0 t -74.61 -173.62 1.85 Allowed 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.093 0.957 . . . . 0.0 111.765 175.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 3.0 t -81.9 39.66 0.57 Allowed 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 125.812 1.645 . . . . 0.0 112.404 178.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -144.28 148.97 35.54 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 126.848 2.059 . . . . 0.0 109.248 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 28.4 m -69.33 156.6 38.52 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 122.851 1.31 . . . . 0.0 114.368 -173.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 54.2 p90 -146.86 155.77 42.58 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.272 1.429 . . . . 0.0 111.999 -175.222 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.3 t -96.01 135.76 29.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 125.594 1.557 . . . . 0.0 107.646 169.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -119.41 129.23 54.68 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.169 1.388 . . . . 0.0 108.841 -175.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -130.94 155.72 46.31 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.282 1.433 . . . . 0.0 113.144 -168.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 18.2 t90 -123.32 139.09 54.39 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.662 1.185 . . . . 0.0 112.257 179.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -133.07 147.66 52.18 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.214 1.406 . . . . 0.0 113.665 -173.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 51.2 ttp180 -110.28 141.11 43.73 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 127.419 2.288 . . . . 0.0 108.567 169.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 38.2 mtp -92.94 145.87 24.05 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.252 0.933 . . . . 0.0 112.155 178.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 24.0 p -90.85 165.54 21.87 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 123.626 0.77 . . . . 0.0 112.983 176.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.01 -29.04 89.59 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 123.589 2.859 . . . . 0.0 113.358 169.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 36.1 m -83.39 12.46 5.45 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.195 1.398 . . . . 0.0 112.89 174.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 63.4 t30 63.44 23.56 13.74 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.554 1.941 . . . . 0.0 113.353 178.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 46.4 mm-40 -89.7 -172.73 3.67 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.483 0.713 . . . . 0.0 109.798 170.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.4 p -137.58 143.5 41.55 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.347 1.459 . . . . 0.0 110.902 -176.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -123.73 129.77 51.61 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 126.572 1.949 . . . . 0.0 109.775 -178.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 74.3 tttt -86.6 119.66 27.08 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.604 1.162 . . . . 0.0 110.962 -171.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 65.9 mt -95.04 -51.07 4.81 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.696 1.199 . . . . 0.0 112.381 -168.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -167.37 171.72 10.34 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.321 1.448 . . . . 0.0 111.564 -174.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -150.09 158.36 44.08 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.104 1.362 . . . . 0.0 113.112 -169.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -137.26 136.94 21.33 Favored Pre-proline 0 CA--C 1.548 0.895 0 C-N-CA 125.687 1.595 . . . . 0.0 110.203 169.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -58.25 143.82 26.63 Favored 'Cis proline' 0 C--N 1.352 0.75 0 CA-C-N 120.279 1.136 . . . . 0.0 112.089 -8.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -88.04 152.81 21.75 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.248 1.019 . . . . 0.0 112.991 -173.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -153.25 136.81 15.95 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.095 1.358 . . . . 0.0 111.454 171.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -100.04 -8.88 23.29 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.714 1.606 . . . . 0.0 113.19 176.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 12.0 m -75.69 -35.79 60.24 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.297 -0.877 . . . . 0.0 112.435 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -69.83 159.97 81.91 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 124.145 0.978 . . . . 0.0 112.98 173.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -61.09 152.84 68.67 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 123.263 2.642 . . . . 0.0 111.31 167.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 99.96 17.29 25.77 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 124.023 0.82 . . . . 0.0 113.848 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -61.04 135.55 57.81 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.143 0.977 . . . . 0.0 110.81 173.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -142.89 148.83 37.63 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.441 1.496 . . . . 0.0 111.602 -178.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 54.5 p -101.4 -7.73 22.65 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 115.673 1.731 . . . . 0.0 115.673 -172.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.3 ptp85 -123.98 -18.97 5.79 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 115.247 1.573 . . . . 0.0 115.247 -169.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -111.88 140.48 46.5 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.714 1.606 . . . . 0.0 111.138 177.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 21.2 ttt-85 -144.4 143.72 31.06 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.832 0.853 . . . . 0.0 113.024 174.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 60.1 t -111.75 127.15 69.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 125.154 1.381 . . . . 0.0 107.704 167.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 76.3 m -130.55 129.55 42.96 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.09 0.956 . . . . 0.0 109.954 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -80.27 139.74 36.52 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.49 0.716 . . . . 0.0 110.978 176.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 30.6 mt -84.56 160.38 56.52 Favored Pre-proline 0 CA--C 1.545 0.766 0 C-N-CA 124.906 1.282 . . . . 0.0 111.669 176.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -62.32 -5.07 6.11 Favored 'Trans proline' 0 CA--C 1.543 0.931 0 C-N-CA 123.542 2.828 . . . . 0.0 114.704 174.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -62.64 -26.13 68.47 Favored 'General case' 0 CA--C 1.551 1.019 0 CA-C-N 119.569 1.077 . . . . 0.0 112.746 169.085 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 94.08 -17.06 59.56 Favored Glycine 0 N--CA 1.475 1.274 0 C-N-CA 125.59 1.567 . . . . 0.0 114.692 173.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 11.0 ptp180 -154.5 73.61 0.91 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.477 1.511 . . . . 0.0 109.839 169.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -166.44 140.6 4.19 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 128.652 2.781 . . . . 0.0 107.003 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -141.16 143.04 34.02 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 -166.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 17.1 m170 -105.55 132.84 51.21 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.524 1.529 . . . . 0.0 111.711 169.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -112.73 101.82 9.9 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 127.154 2.182 . . . . 0.0 109.298 -178.023 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 60.6 m -109.23 124.12 50.35 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 -169.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 37.2 t -93.53 125.99 46.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 126.278 1.831 . . . . 0.0 106.401 167.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 57.9 t -96.57 126.57 49.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 124.069 0.948 . . . . 0.0 109.408 171.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 67.1 ttt180 58.32 66.15 1.15 Allowed 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.778 1.631 . . . . 0.0 111.826 174.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -72.37 135.54 45.89 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 121.351 -0.843 . . . . 0.0 111.798 -178.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -111.49 164.86 12.52 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.93 1.692 . . . . 0.0 110.202 174.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 31.0 mtp180 -56.88 -32.99 66.41 Favored 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -171.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -64.97 -16.11 62.99 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 175.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 65.5 m-20 -79.73 -13.52 59.39 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 119.329 0.968 . . . . 0.0 112.8 173.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 20.4 m -63.45 129.23 39.36 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 120.868 -1.145 . . . . 0.0 111.566 177.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 158.8 -169.04 35.07 Favored Glycine 0 N--CA 1.47 0.908 0 C-N-CA 124.183 0.896 . . . . 0.0 113.286 -172.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.4 m -92.79 143.27 26.45 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.727 1.211 . . . . 0.0 111.267 -173.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -141.73 157.19 45.35 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.542 1.937 . . . . 0.0 111.267 -177.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -160.53 159.93 31.29 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.855 1.262 . . . . 0.0 113.617 177.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 39.1 t -103.07 149.47 24.56 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.911 1.685 . . . . 0.0 111.57 177.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -144.57 152.64 24.55 Favored Glycine 0 N--CA 1.471 1.015 0 C-N-CA 124.688 1.137 . . . . 0.0 113.182 175.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -132.39 154.63 49.62 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.629 1.171 . . . . 0.0 112.775 -176.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.3 tt -153.31 135.41 6.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 125.104 1.361 . . . . 0.0 110.995 177.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 12.6 m -67.98 158.28 33.17 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 121.099 -1.001 . . . . 0.0 112.498 177.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.7 -9.18 56.6 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 115.689 1.737 . . . . 0.0 115.689 -177.247 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -78.38 144.16 65.67 Favored Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 124.241 1.016 . . . . 0.0 112.281 -178.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -55.56 -29.04 68.01 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 123.748 2.965 . . . . 0.0 114.858 177.22 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -76.99 -5.99 50.85 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 115.056 1.502 . . . . 0.0 115.056 179.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.41 164.2 23.54 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.519 1.127 . . . . 0.0 113.365 -176.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -144.59 161.34 39.37 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.674 1.589 . . . . 0.0 110.295 173.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 56.8 mt -78.98 118.17 25.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 123.65 0.78 . . . . 0.0 111.158 -172.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 59.0 tttp -89.62 137.53 32.25 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.719 1.608 . . . . 0.0 109.214 168.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -115.29 152.75 32.18 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.448 1.099 . . . . 0.0 112.147 -173.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 78.3 p -97.59 172.55 7.65 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.077 1.351 . . . . 0.0 114.118 177.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 14.4 tp -69.99 119.8 14.75 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.144 1.378 . . . . 0.0 108.607 169.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 34.8 ptt-85 -71.35 163.93 26.72 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.101 1.36 . . . . 0.0 113.879 -175.041 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -142.64 169.65 17.18 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.807 2.043 . . . . 0.0 111.234 179.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -117.65 146.16 43.87 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 114.055 1.131 . . . . 0.0 114.055 174.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 66.8 tp -100.21 137.11 39.1 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 127.112 2.165 . . . . 0.0 108.875 169.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 29.3 ttm180 -132.02 117.56 18.55 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.293 1.437 . . . . 0.0 109.964 178.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 40.6 t -106.46 113.21 42.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 125.226 1.41 . . . . 0.0 108.904 178.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 73.8 p -95.01 160.69 14.46 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.824 1.65 . . . . 0.0 111.47 -178.349 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -57.74 144.9 36.46 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.732 1.213 . . . . 0.0 113.686 -173.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 69.7 ttp85 -66.63 118.2 9.87 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 124.278 1.031 . . . . 0.0 109.607 179.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.71 152.65 45.25 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -175.193 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -64.72 154.29 37.17 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.364 1.066 . . . . 0.0 113.447 179.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 . . . . . 0 N--CA 1.49 1.533 0 C-N-CA 130.605 3.562 . . . . 0.0 113.022 176.718 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 4.7 mpp? . . . . . 0 N--CA 1.489 1.498 0 CA-C-O 116.768 -1.587 . . . . 0.0 114.418 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -73.06 159.73 47.12 Favored 'Trans proline' 0 C--N 1.357 0.988 0 C-N-CA 122.436 2.091 . . . . 0.0 112.218 -173.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -64.75 114.59 2.82 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 124.008 3.138 . . . . 0.0 111.535 -178.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.1 t -167.68 163.3 14.37 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.826 1.25 . . . . 0.0 113.221 -174.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -152.78 119.88 5.84 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.66 1.984 . . . . 0.0 110.658 175.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 94.9 p -140.93 164.19 37.72 Favored Pre-proline 0 CA--C 1.553 1.075 0 C-N-CA 125.446 1.498 . . . . 0.0 112.755 -172.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -70.24 170.65 59.52 Favored 'Cis proline' 0 C--N 1.355 0.873 0 CA-C-N 120.629 1.26 . . . . 0.0 112.396 -2.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.04 -32.94 74.42 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 171.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 49.1 tp -144.92 124.69 13.36 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.559 1.544 . . . . 0.0 109.586 171.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 62.1 tp -102.18 132.75 47.9 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.975 1.31 . . . . 0.0 108.888 169.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 24.7 t -112.65 127.29 69.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 124.072 0.949 . . . . 0.0 108.466 171.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 33.2 m -131.4 166.26 29.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 124.624 1.17 . . . . 0.0 111.708 175.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 25.4 m -90.5 148.91 22.43 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.258 1.023 . . . . 0.0 110.229 173.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -59.13 116.05 3.59 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.544 1.538 . . . . 0.0 111.357 176.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.17 5.47 65.7 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 126.385 1.945 . . . . 0.0 114.765 -174.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -92.05 154.78 18.54 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.355 1.578 . . . . 0.0 112.132 173.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -71.08 120.44 16.65 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.455 1.102 . . . . 0.0 110.753 173.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -97.9 128.09 44.27 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 117.867 -1.063 . . . . 0.0 110.076 174.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 28.4 m -132.74 132.08 41.89 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.169 0.988 . . . . 0.0 111.184 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -119.97 159.55 24.5 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 128.03 2.532 . . . . 0.0 109.982 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 49.7 m -105.44 124.44 49.55 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.332 1.053 . . . . 0.0 109.468 178.216 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 54.1 t -118.45 150.37 39.69 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.849 1.259 . . . . 0.0 110.908 169.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 27.4 t -152.9 146.49 25.04 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 120.734 -1.229 . . . . 0.0 111.763 169.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 48.3 m-85 -146.24 156.11 43.15 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 127.981 2.513 . . . . 0.0 110.887 172.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.7 t -141.34 142.87 33.78 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.083 1.353 . . . . 0.0 109.369 169.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -139.36 155.29 47.76 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.606 1.162 . . . . 0.0 112.184 -173.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 24.3 p -83.83 -16.41 44.67 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 126.097 1.759 . . . . 0.0 114.388 -173.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 7.3 t -81.72 -176.93 6.33 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.89 0.876 . . . . 0.0 112.613 176.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -73.07 -23.22 60.53 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.861 1.264 . . . . 0.0 113.498 -172.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.7 t -169.14 166.52 10.8 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.11 1.764 . . . . 0.0 110.798 -179.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -150.57 151.2 32.24 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.667 1.187 . . . . 0.0 112.171 177.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 24.8 t -96.05 133.58 36.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 125.48 1.512 . . . . 0.0 107.853 172.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 14.6 tp -99.42 140.76 33.13 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.445 1.098 . . . . 0.0 110.088 172.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -132.32 151.98 51.61 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.466 1.906 . . . . 0.0 110.507 -179.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 14.1 t90 -125.9 146.15 49.96 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.091 0.956 . . . . 0.0 112.405 178.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -141.07 143.52 34.4 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 -169.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -103.96 142.05 35.1 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.05 1.34 . . . . 0.0 107.951 167.126 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 22.6 mtp -88.49 145.91 25.48 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 118.897 0.771 . . . . 0.0 112.659 179.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 64.5 m -96.1 152.26 38.76 Favored Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 125.134 1.374 . . . . 0.0 110.923 171.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -67.52 -12.62 36.32 Favored 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 123.632 2.888 . . . . 0.0 113.621 -179.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 29.1 p -76.96 4.04 10.84 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 126.255 1.822 . . . . 0.0 113.633 169.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 59.8 t30 67.04 41.51 2.63 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.88 2.072 . . . . 0.0 111.347 -174.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 21.5 mm-40 -121.46 -172.69 2.47 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.59 1.956 . . . . 0.0 109.594 176.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 12.5 p -146.3 152.56 39.34 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.102 1.361 . . . . 0.0 111.404 -172.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -127.04 132.37 50.72 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.988 1.315 . . . . 0.0 110.919 173.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -78.75 124.98 28.76 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.484 1.114 . . . . 0.0 111.21 -175.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 74.0 mt -100.66 -44.61 5.77 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.341 1.456 . . . . 0.0 112.829 -169.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -166.21 170.92 12.79 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.165 1.786 . . . . 0.0 110.638 -171.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -155.93 163.43 39.76 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.661 1.184 . . . . 0.0 112.796 -177.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -141.8 121.31 8.1 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 125.269 1.428 . . . . 0.0 110.035 169.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -54.83 146.97 18.47 Favored 'Cis proline' 0 C--N 1.352 0.736 0 CA-C-N 120.378 1.171 . . . . 0.0 112.984 -7.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -80.41 144.07 32.95 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 121.976 0.893 . . . . 0.0 113.293 -170.327 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -85.11 33.46 0.54 Allowed 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.818 1.647 . . . . 0.0 113.062 -174.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 6.9 ppt_? -63.56 -8.13 8.92 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 115.799 1.778 . . . . 0.0 115.799 -169.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 33.1 p -73.21 -19.42 61.09 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.648 1.179 . . . . 0.0 113.116 171.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -106.17 164.58 14.65 Favored Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 125.48 1.512 . . . . 0.0 111.118 174.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_exo -56.66 160.66 11.31 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 124.061 3.174 . . . . 0.0 113.942 173.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 91.94 31.11 9.49 Favored Glycine 0 CA--C 1.533 1.201 0 C-N-CA 124.17 0.891 . . . . 0.0 113.135 -174.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -72.37 -20.87 61.38 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.846 1.258 . . . . 0.0 113.445 -175.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -142.94 55.4 1.39 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.151 1.38 . . . . 0.0 111.286 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 50.8 m -84.21 9.45 12.8 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.976 1.31 . . . . 0.0 113.866 178.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 43.7 mtm180 80.63 -34.13 0.12 Allowed 'General case' 0 C--N 1.346 0.432 0 C-N-CA 131.493 3.917 . . . . 0.0 113.803 178.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -65.03 129.46 39.79 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.356 1.462 . . . . 0.0 110.813 169.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 59.0 ttp85 -144.45 154.0 42.48 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.733 1.613 . . . . 0.0 112.102 -170.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 17.7 t -117.54 138.02 49.57 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 125.994 1.718 . . . . 0.0 110.166 173.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 3.1 m -114.54 128.38 56.3 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.237 1.415 . . . . 0.0 110.153 171.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 28.0 tp60 -84.84 122.38 29.07 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.531 1.132 . . . . 0.0 108.222 168.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 24.6 mt -84.56 154.96 62.52 Favored Pre-proline 0 N--CA 1.472 0.668 0 CA-C-O 118.766 -0.635 . . . . 0.0 110.751 176.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -65.95 -4.93 10.99 Favored 'Trans proline' 0 CA--C 1.54 0.777 0 C-N-CA 123.571 2.847 . . . . 0.0 113.926 176.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -64.95 -26.12 68.17 Favored 'General case' 0 CA--C 1.55 0.96 0 CA-C-N 119.434 1.016 . . . . 0.0 112.182 169.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 85.44 -34.09 3.34 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 126.592 2.044 . . . . 0.0 113.867 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 17.2 mtp180 -125.88 73.51 1.35 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.771 1.228 . . . . 0.0 109.197 174.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 174.12 142.2 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 128.757 2.823 . . . . 0.0 109.057 -174.701 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 84.6 m-85 -149.79 151.46 33.6 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.553 1.141 . . . . 0.0 112.66 -167.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 5.8 m-70 -116.34 114.48 24.37 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.512 0.725 . . . . 0.0 111.344 169.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 24.6 mmt -84.23 144.04 29.19 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.293 1.037 . . . . 0.0 109.371 172.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 72.3 p -151.36 151.77 32.21 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 115.565 1.691 . . . . 0.0 115.565 -179.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 16.0 t -109.69 116.2 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 125.526 1.531 . . . . 0.0 107.466 169.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 96.9 t -70.86 112.52 5.78 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 170.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 80.5 mtt85 57.49 77.09 0.29 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.392 1.477 . . . . 0.0 111.317 178.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.29 132.88 45.56 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.595 1.158 . . . . 0.0 111.325 -179.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 8.6 mpt_? -105.84 163.26 12.86 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.767 1.627 . . . . 0.0 109.989 176.143 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 73.9 mtm180 -57.52 -20.23 30.12 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 175.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -54.59 -29.95 53.06 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.977 1.711 . . . . 0.0 113.668 167.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 36.4 m-20 -93.21 -12.74 29.52 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.059 1.344 . . . . 0.0 114.551 -168.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 49.5 m -59.42 139.46 57.06 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 119.602 1.092 . . . . 0.0 112.768 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 149.35 -163.83 29.27 Favored Glycine 0 N--CA 1.472 1.053 0 C-N-CA 124.131 0.872 . . . . 0.0 113.435 -178.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.7 m -92.64 147.53 22.8 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.006 1.322 . . . . 0.0 110.702 -178.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -142.29 158.75 43.37 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.641 1.976 . . . . 0.0 111.253 -176.126 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.5 pp -154.36 158.84 40.69 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.914 1.286 . . . . 0.0 112.112 172.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 9.3 t -108.45 161.48 15.0 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.071 1.748 . . . . 0.0 110.291 177.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -157.46 155.3 26.29 Favored Glycine 0 N--CA 1.47 0.943 0 O-C-N 120.945 -1.097 . . . . 0.0 114.36 176.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -130.58 154.2 48.09 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.433 1.093 . . . . 0.0 112.818 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.6 tt -148.21 135.3 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 125.428 1.491 . . . . 0.0 110.528 176.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 23.3 m -67.04 161.1 25.16 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -179.285 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.26 -17.5 64.55 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 -175.657 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -78.51 148.9 74.33 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 124.744 1.218 . . . . 0.0 112.473 -177.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -67.9 -23.08 41.5 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.108 2.539 . . . . 0.0 113.069 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.8 pttp -80.31 -1.76 42.36 Favored 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 114.654 1.353 . . . . 0.0 114.654 176.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -67.83 164.32 19.89 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.731 1.212 . . . . 0.0 113.135 -179.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -137.05 155.77 49.24 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.771 1.628 . . . . 0.0 109.394 176.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 50.8 mt -79.24 125.25 38.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 123.343 0.657 . . . . 0.0 110.673 -176.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -95.69 120.91 36.79 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.899 1.68 . . . . 0.0 109.414 169.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -91.57 151.81 20.57 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.661 1.185 . . . . 0.0 112.223 -177.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 56.0 p -85.99 178.96 7.09 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.347 1.059 . . . . 0.0 112.426 169.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -71.67 159.33 34.59 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.523 -0.735 . . . . 0.0 110.688 166.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 70.3 mtt180 -75.41 143.43 42.73 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 123.991 0.916 . . . . 0.0 112.172 -178.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -124.17 166.46 15.79 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.749 2.02 . . . . 0.0 110.105 169.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -126.66 152.76 46.29 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.579 1.151 . . . . 0.0 111.707 177.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 64.7 tp -125.35 132.9 52.75 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 126.181 1.792 . . . . 0.0 109.4 172.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 53.9 ttp180 -123.0 117.19 24.91 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.948 1.299 . . . . 0.0 109.875 169.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 40.8 t -96.29 120.37 45.57 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 169.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 82.8 p -99.07 149.29 23.17 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.752 1.621 . . . . 0.0 109.932 177.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 38.8 mp0 -53.31 149.01 7.83 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.8 1.24 . . . . 0.0 113.402 -174.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -62.6 123.48 18.47 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 124.543 1.137 . . . . 0.0 109.667 -178.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 66.2 mtt-85 -76.12 153.31 36.37 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.874 0.87 . . . . 0.0 112.835 -167.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -71.49 154.38 41.53 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.554 1.142 . . . . 0.0 112.424 175.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 . . . . . 0 C--O 1.252 1.184 0 C-N-CA 125.186 1.394 . . . . 0.0 112.998 176.907 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 5.3 mpp? . . . . . 0 N--CA 1.489 1.477 0 CA-C-O 118.65 -0.691 . . . . 0.0 110.445 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -77.21 171.1 18.39 Favored 'Trans proline' 0 CA--C 1.547 1.128 0 C-N-CA 123.842 3.028 . . . . 0.0 111.875 175.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_exo -54.04 144.03 59.27 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 124.249 3.299 . . . . 0.0 112.22 168.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 17.0 p -136.64 137.79 40.44 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.59 1.156 . . . . 0.0 111.185 -178.058 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -120.85 140.09 52.25 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.97 1.308 . . . . 0.0 110.527 -174.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 16.9 m -140.91 156.76 68.47 Favored Pre-proline 0 CA--C 1.547 0.855 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 178.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -71.1 155.13 96.94 Favored 'Cis proline' 0 C--N 1.35 0.655 0 N-CA-C 110.367 -0.666 . . . . 0.0 110.367 -12.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.68 -30.19 67.18 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 173.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 46.0 tp -138.53 118.86 13.67 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.645 1.578 . . . . 0.0 109.095 170.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.4 tp -101.19 126.89 47.95 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.241 1.416 . . . . 0.0 109.229 172.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.6 t -109.79 124.54 66.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 171.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.8 m -128.09 174.28 11.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 C-N-CA 124.814 1.245 . . . . 0.0 111.284 172.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 33.8 m -104.34 151.85 22.96 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.657 1.583 . . . . 0.0 110.281 174.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -45.25 122.87 3.66 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.082 1.753 . . . . 0.0 112.509 171.728 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.27 0.42 89.48 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 125.902 1.715 . . . . 0.0 115.126 -179.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -88.08 155.77 19.63 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 119.768 1.784 . . . . 0.0 112.629 177.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -76.14 121.83 23.42 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.839 1.256 . . . . 0.0 110.771 173.13 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -101.4 131.45 47.48 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.112 0.965 . . . . 0.0 110.688 175.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 21.3 m -132.76 124.96 29.07 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.822 0.849 . . . . 0.0 111.531 -178.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -104.96 159.46 15.8 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 126.041 1.736 . . . . 0.0 111.102 170.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 32.2 m -120.52 138.59 53.76 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.615 1.566 . . . . 0.0 110.052 177.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 74.4 m -128.6 137.5 51.73 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.023 1.329 . . . . 0.0 110.938 169.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 47.6 p -124.89 140.9 52.51 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.39 0.676 . . . . 0.0 109.673 170.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -127.07 140.8 52.03 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 113.988 1.107 . . . . 0.0 113.988 -169.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 12.6 p -99.12 138.49 36.15 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.671 1.588 . . . . 0.0 107.652 165.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -159.04 138.44 11.51 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.139 -0.976 . . . . 0.0 111.847 -169.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.2 p -79.75 -18.43 51.12 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 125.732 1.613 . . . . 0.0 113.979 -176.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 8.0 t -88.49 177.69 6.73 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.269 1.028 . . . . 0.0 111.839 172.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -74.1 -34.53 63.99 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.849 1.26 . . . . 0.0 111.275 176.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.1 t -160.01 174.39 14.43 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.802 1.241 . . . . 0.0 111.739 -179.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 42.7 p90 -160.82 164.14 31.6 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.493 1.517 . . . . 0.0 111.743 -169.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 40.7 t -95.85 125.5 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 N-CA-C 106.487 -1.671 . . . . 0.0 106.487 169.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 37.6 tp -99.38 139.33 35.19 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 123.054 0.541 . . . . 0.0 109.647 174.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -128.16 137.12 51.94 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.544 1.538 . . . . 0.0 109.997 -176.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 68.9 t-105 -98.19 134.93 40.56 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.68 1.192 . . . . 0.0 110.699 173.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 90.5 m-85 -124.2 143.42 50.52 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.913 1.285 . . . . 0.0 112.805 -178.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 56.8 ttp85 -95.83 142.96 27.48 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 126.542 1.937 . . . . 0.0 107.874 167.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 33.1 mtp -91.61 144.89 25.07 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 118.826 0.739 . . . . 0.0 112.206 172.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 58.8 m -108.96 149.49 39.67 Favored Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 125.559 1.543 . . . . 0.0 110.85 171.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -69.01 -14.88 39.32 Favored 'Trans proline' 0 C--N 1.353 0.784 0 C-N-CA 123.879 3.053 . . . . 0.0 114.482 -171.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 6.1 t -76.91 7.92 4.31 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 119.098 0.863 . . . . 0.0 113.153 170.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 34.3 m-80 75.6 36.79 0.45 Allowed 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 127.896 2.479 . . . . 0.0 112.039 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -115.84 172.61 7.03 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.176 1.39 . . . . 0.0 111.007 179.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.8 p -132.62 152.49 51.63 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 125.842 1.657 . . . . 0.0 111.505 -178.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -138.51 125.89 21.77 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.539 1.536 . . . . 0.0 110.927 -177.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -77.64 125.33 29.17 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.138 0.975 . . . . 0.0 111.218 -176.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 25.4 mt -102.09 -43.35 5.78 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.894 0.878 . . . . 0.0 112.944 -179.016 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -157.46 168.13 28.22 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.377 1.471 . . . . 0.0 111.455 -172.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.66 167.86 27.41 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.44 1.096 . . . . 0.0 112.862 -178.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -142.22 126.16 9.84 Favored Pre-proline 0 CA--C 1.543 0.674 0 C-N-CA 124.661 1.185 . . . . 0.0 110.33 169.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -56.76 153.83 28.38 Favored 'Cis proline' 0 C--N 1.351 0.677 0 CA-C-N 119.355 0.805 . . . . 0.0 112.725 -10.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -75.88 94.75 3.39 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 121.677 0.751 . . . . 0.0 111.659 -177.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -79.15 0.69 27.21 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.032 1.333 . . . . 0.0 113.645 173.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 64.6 mtm180 -61.24 -33.07 72.9 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.362 1.465 . . . . 0.0 112.164 176.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.7 t 70.29 -61.08 0.47 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 127.776 2.43 . . . . 0.0 115.381 168.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -101.69 149.05 36.1 Favored Pre-proline 0 CA--C 1.545 0.75 0 C-N-CA 124.446 1.099 . . . . 0.0 112.425 -169.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -80.32 164.79 21.49 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 124.06 3.173 . . . . 0.0 111.673 175.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 103.66 -5.76 47.97 Favored Glycine 0 N--CA 1.473 1.157 0 C-N-CA 125.291 1.425 . . . . 0.0 112.933 179.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.2 178.97 7.85 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.78 1.632 . . . . 0.0 111.991 171.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 19.2 m-20 -70.39 77.24 0.55 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.125 1.37 . . . . 0.0 112.363 178.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 82.0 p -68.82 -6.59 27.78 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.792 1.637 . . . . 0.0 113.933 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 5.2 ptm180 -68.6 -16.94 64.01 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.055 1.342 . . . . 0.0 113.71 171.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -97.8 125.53 42.69 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.898 1.279 . . . . 0.0 109.33 172.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -142.94 152.53 42.11 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.472 1.109 . . . . 0.0 111.945 -169.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 49.0 t -126.6 139.85 50.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.116 0 C-N-CA 124.856 1.262 . . . . 0.0 111.021 176.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 97.4 m -123.38 128.89 50.51 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.538 1.535 . . . . 0.0 109.509 170.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 37.2 tt0 -85.9 137.74 32.53 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.887 0.875 . . . . 0.0 110.149 170.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 34.3 mt -91.1 157.31 43.14 Favored Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 124.357 1.063 . . . . 0.0 111.894 -179.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -66.75 -3.85 10.08 Favored 'Trans proline' 0 CA--C 1.542 0.91 0 C-N-CA 123.664 2.91 . . . . 0.0 114.028 174.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -66.59 -13.66 61.37 Favored 'General case' 0 CA--C 1.555 1.147 0 CA-C-N 119.378 0.99 . . . . 0.0 112.951 170.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 92.32 -24.57 21.85 Favored Glycine 0 N--CA 1.476 1.307 0 C-N-CA 125.916 1.722 . . . . 0.0 115.716 168.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 11.5 ptp180 -154.5 73.64 0.92 Allowed 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.534 1.534 . . . . 0.0 109.695 172.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -168.89 137.0 2.01 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 128.074 2.55 . . . . 0.0 107.273 -171.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 55.1 m-85 -148.78 146.58 28.09 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -167.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 4.8 m-70 -106.03 132.5 52.04 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.283 1.433 . . . . 0.0 111.116 168.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 2.6 mpp? -112.1 120.31 41.4 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 126.361 1.864 . . . . 0.0 109.365 177.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 36.0 m -116.22 130.89 57.01 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.322 1.049 . . . . 0.0 112.211 -169.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 58.1 t -105.66 110.79 32.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 125.775 1.63 . . . . 0.0 107.13 168.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 96.8 t -76.29 123.44 32.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.495 1.118 . . . . 0.0 109.55 178.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 53.63 73.43 0.38 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.053 1.741 . . . . 0.0 111.574 177.047 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.87 132.26 44.15 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.195 0.998 . . . . 0.0 111.269 -179.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -106.94 161.65 14.53 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 126.198 1.799 . . . . 0.0 110.104 177.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -50.68 -35.79 32.69 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 119.292 0.951 . . . . 0.0 113.377 -178.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -62.88 -21.1 65.74 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 125.564 1.546 . . . . 0.0 115.003 176.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -76.4 -11.87 59.96 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 119.69 1.132 . . . . 0.0 113.116 177.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.9 m -62.93 131.08 47.5 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 120.617 -1.302 . . . . 0.0 112.349 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 156.99 -168.77 34.04 Favored Glycine 0 N--CA 1.472 1.055 0 C-N-CA 124.381 0.991 . . . . 0.0 113.703 -173.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.2 m -95.8 142.48 28.03 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.623 1.169 . . . . 0.0 111.219 -175.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -146.1 160.91 41.27 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.149 1.78 . . . . 0.0 111.071 -177.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -161.77 169.07 22.08 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 120.871 -1.143 . . . . 0.0 113.99 -175.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 6.4 m -107.06 148.26 28.96 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.178 1.391 . . . . 0.0 112.356 175.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -145.66 135.77 6.1 Favored Glycine 0 N--CA 1.469 0.859 0 C-N-CA 125.02 1.295 . . . . 0.0 111.523 169.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -113.96 157.28 22.65 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.008 0.923 . . . . 0.0 112.82 -176.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 19.7 tt -143.41 131.49 18.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 125.141 1.377 . . . . 0.0 110.226 172.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 15.3 m -68.27 161.61 26.88 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.179 1.392 . . . . 0.0 114.152 -171.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.9 -10.92 32.36 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 116.119 1.896 . . . . 0.0 116.119 -176.576 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -81.47 149.83 65.76 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.766 1.227 . . . . 0.0 112.427 -178.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -68.09 -21.5 42.63 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 123.038 2.492 . . . . 0.0 112.699 175.59 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 1.9 tppp? -81.52 -4.07 54.93 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 125.217 1.407 . . . . 0.0 113.66 177.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.5 164.69 13.5 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.813 1.245 . . . . 0.0 113.986 -175.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 38.0 tt0 -152.44 141.25 21.02 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.228 1.811 . . . . 0.0 108.437 -178.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 60.7 mt -59.62 140.5 17.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 124.189 0.996 . . . . 0.0 112.227 -172.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 32.5 mmtm -125.74 124.33 40.8 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.743 1.617 . . . . 0.0 110.306 169.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -147.74 141.92 26.12 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.119 1.767 . . . . 0.0 110.93 -174.417 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 8.4 t -173.35 156.65 3.14 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 126.259 1.824 . . . . 0.0 109.982 -179.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.1 mp 68.94 173.88 0.29 Allowed 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 127.293 2.237 . . . . 0.0 111.209 -169.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -159.63 168.22 26.57 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.611 1.564 . . . . 0.0 112.49 173.6 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -128.93 161.62 29.46 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 126.946 2.098 . . . . 0.0 110.892 173.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -116.53 139.28 50.66 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.802 1.241 . . . . 0.0 111.081 -178.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 54.4 tp -108.82 132.8 53.65 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 125.684 1.593 . . . . 0.0 109.929 171.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 66.2 ttt180 -122.49 119.38 30.75 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.901 1.68 . . . . 0.0 109.153 169.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 38.6 t -104.64 115.27 46.22 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 124.211 1.004 . . . . 0.0 108.557 171.141 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 80.8 p -87.58 153.3 21.5 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.004 1.721 . . . . 0.0 110.144 177.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 4.2 pm0 -66.52 154.58 39.98 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.696 0.798 . . . . 0.0 112.884 -178.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 19.8 tpt180 -68.6 119.37 12.93 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.99 0.916 . . . . 0.0 109.646 -173.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 75.8 ttt180 -71.4 140.86 50.29 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.136 0.575 . . . . 0.0 111.708 -172.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -70.17 154.29 42.1 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.58 1.152 . . . . 0.0 112.888 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 . . . . . 0 C--O 1.253 1.273 0 C-N-CA 124.999 1.32 . . . . 0.0 114.458 176.697 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 59.2 mtt . . . . . 0 N--CA 1.49 1.575 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.12 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -55.59 154.97 23.03 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 122.832 2.355 . . . . 0.0 110.284 167.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -58.66 109.18 0.48 Allowed 'Trans proline' 0 C--N 1.351 0.658 0 C-N-CA 123.972 3.115 . . . . 0.0 111.492 -169.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.5 t -150.2 156.16 41.08 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.487 1.115 . . . . 0.0 112.191 -169.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 82.8 t80 -145.45 118.06 8.6 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 127.419 2.288 . . . . 0.0 108.732 -175.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 97.8 p -140.84 161.56 53.38 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 124.808 1.243 . . . . 0.0 113.645 -168.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -67.67 161.53 78.85 Favored 'Cis proline' 0 C--N 1.355 0.886 0 CA-C-N 120.041 1.051 . . . . 0.0 111.707 -4.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.64 -24.75 67.76 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 176.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 13.5 tp -139.71 121.04 14.94 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 126.015 1.726 . . . . 0.0 108.487 171.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 61.3 tp -109.67 121.35 45.01 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.38 1.072 . . . . 0.0 108.591 168.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 14.3 p -109.95 126.46 67.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 123.867 0.867 . . . . 0.0 109.779 171.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 27.0 m -130.77 165.77 30.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 125.006 1.323 . . . . 0.0 111.964 176.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.3 m -89.44 147.8 23.81 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.748 1.219 . . . . 0.0 110.489 172.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -52.85 125.99 18.76 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.483 1.113 . . . . 0.0 111.393 174.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 91.06 -2.44 79.25 Favored Glycine 0 CA--C 1.534 1.231 0 C-N-CA 125.305 1.431 . . . . 0.0 114.75 -176.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -87.04 157.19 19.48 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 119.704 1.752 . . . . 0.0 112.275 175.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 53.6 m-20 -90.24 104.45 17.02 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.2 1.0 . . . . 0.0 110.234 178.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -90.27 111.87 23.21 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.843 0.857 . . . . 0.0 111.583 -171.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 25.8 m -113.61 125.13 53.83 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 118.716 0.689 . . . . 0.0 112.318 -173.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -101.89 159.59 15.21 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 127.094 2.158 . . . . 0.0 110.229 169.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.0 m -112.39 132.89 54.78 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.011 1.324 . . . . 0.0 109.847 174.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 43.1 t -117.51 144.4 45.11 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.765 1.626 . . . . 0.0 111.336 171.451 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 46.8 t -147.08 141.51 26.41 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.361 -0.837 . . . . 0.0 111.756 173.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -127.65 156.17 42.76 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 126.529 1.932 . . . . 0.0 113.948 -176.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 69.2 m -111.85 118.21 34.9 Favored 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 166.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -153.38 117.58 4.86 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.242 0.617 . . . . 0.0 111.722 -168.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 19.1 p -96.4 106.35 18.57 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.733 1.613 . . . . 0.0 109.648 177.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 33.0 t -172.64 167.16 5.44 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.016 1.726 . . . . 0.0 110.432 -174.264 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -73.94 -24.54 59.67 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.563 0.745 . . . . 0.0 111.366 168.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 5.3 t -170.28 164.39 8.94 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.271 1.828 . . . . 0.0 112.088 173.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 53.2 p90 -149.72 150.64 32.39 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.905 1.282 . . . . 0.0 111.48 174.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 49.1 t -96.07 128.7 47.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 C-N-CA 125.224 1.409 . . . . 0.0 107.68 173.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -112.95 122.02 46.38 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.433 1.493 . . . . 0.0 109.006 -175.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 11.4 m-80 -122.57 158.53 29.71 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.369 1.467 . . . . 0.0 112.788 -168.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 10.0 t90 -124.18 137.69 54.51 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 125.311 1.444 . . . . 0.0 112.068 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -132.99 141.09 48.11 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.786 1.234 . . . . 0.0 113.077 -176.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.5 ttt-85 -101.14 140.93 34.74 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.393 1.477 . . . . 0.0 108.258 168.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 29.8 mtp -91.98 145.92 24.15 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 119.04 0.836 . . . . 0.0 111.978 178.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 67.4 m -96.64 158.95 32.8 Favored Pre-proline 0 CA--C 1.549 0.906 0 C-N-CA 124.369 1.068 . . . . 0.0 112.064 174.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -56.57 -34.26 94.9 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 123.944 3.096 . . . . 0.0 113.654 174.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 9.6 m -77.01 18.03 0.4 Allowed 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.617 1.567 . . . . 0.0 113.529 175.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . 0.318 13.6 p30 58.01 21.04 7.37 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 128.263 2.625 . . . . 0.0 115.623 -176.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 18.7 mm100 -82.98 -178.06 6.99 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.052 0.941 . . . . 0.0 110.556 169.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -148.65 141.99 25.18 Favored 'General case' 0 CA--C 1.518 -0.271 0 C-N-CA 127.185 2.194 . . . . 0.0 108.546 -171.399 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -127.27 120.06 27.77 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 125.846 1.659 . . . . 0.0 109.359 -172.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 57.8 tttm -76.92 117.02 18.1 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.888 1.275 . . . . 0.0 110.868 -176.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 37.2 mt -94.45 -50.04 5.4 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.834 1.254 . . . . 0.0 112.966 -168.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -171.23 170.46 6.03 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.74 2.016 . . . . 0.0 110.33 -169.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.69 165.53 32.41 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.588 1.155 . . . . 0.0 112.963 -176.46 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -129.93 130.21 23.12 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 125.95 1.7 . . . . 0.0 109.268 169.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -57.74 149.59 32.91 Favored 'Cis proline' 0 C--N 1.351 0.67 0 CA-C-N 120.359 1.164 . . . . 0.0 112.734 -7.026 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -76.34 152.86 36.24 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.981 0.912 . . . . 0.0 113.26 -174.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -129.87 125.13 34.88 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.266 1.427 . . . . 0.0 110.355 173.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -101.7 1.89 38.01 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.144 1.378 . . . . 0.0 113.704 -178.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 55.1 m -105.58 -29.94 9.83 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.743 1.217 . . . . 0.0 113.44 -173.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 18.6 mm100 -72.72 145.36 86.95 Favored Pre-proline 0 CA--C 1.546 0.813 0 O-C-N 121.453 -0.779 . . . . 0.0 111.958 -179.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -79.95 0.57 9.92 Favored 'Trans proline' 0 CA--C 1.538 0.693 0 C-N-CA 123.843 3.029 . . . . 0.0 114.385 -173.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -85.86 -0.52 87.5 Favored Glycine 0 CA--C 1.533 1.2 0 C-N-CA 125.011 1.291 . . . . 0.0 113.773 178.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -69.25 147.43 51.24 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.836 1.254 . . . . 0.0 112.345 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -143.01 148.2 36.37 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.247 1.419 . . . . 0.0 111.501 175.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 14.9 m -68.5 -26.29 65.39 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.826 1.417 . . . . 0.0 114.826 -175.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 89.6 mtt180 -78.22 -48.38 15.95 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.026 0.83 . . . . 0.0 112.055 -177.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -85.69 122.03 29.21 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.477 1.111 . . . . 0.0 111.966 -169.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -140.32 140.55 35.65 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.967 1.307 . . . . 0.0 110.539 -173.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.5 t -126.52 130.87 71.77 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 124.922 1.289 . . . . 0.0 110.01 -177.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 89.7 m -130.17 127.99 40.84 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.933 1.293 . . . . 0.0 110.427 -179.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -79.97 140.11 36.76 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.114 0.965 . . . . 0.0 110.997 173.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 27.1 mt -97.63 159.32 31.33 Favored Pre-proline 0 CA--C 1.546 0.827 0 C-N-CA 125.056 1.342 . . . . 0.0 111.487 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -67.0 -3.68 10.11 Favored 'Trans proline' 0 CA--C 1.543 0.944 0 C-N-CA 123.681 2.921 . . . . 0.0 114.351 175.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -69.05 -8.86 49.06 Favored 'General case' 0 CA--C 1.557 1.243 0 CA-C-N 119.364 0.983 . . . . 0.0 113.277 172.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 90.01 -34.08 4.23 Favored Glycine 0 N--CA 1.476 1.351 0 C-N-CA 126.439 1.971 . . . . 0.0 115.971 168.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 78.9 mtt85 -140.06 73.61 1.43 Allowed 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.862 1.265 . . . . 0.0 109.11 169.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -165.79 136.06 3.54 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 125.649 1.58 . . . . 0.0 108.577 -171.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -146.89 131.46 17.77 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.96 0.904 . . . . 0.0 111.734 -167.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 5.0 m-70 -94.53 133.87 37.69 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.743 0.817 . . . . 0.0 110.7 169.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 32.1 mtt -123.44 105.31 9.69 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 126.387 1.875 . . . . 0.0 109.242 -174.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 7.2 t -112.83 128.91 56.57 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -169.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 15.2 t -92.86 90.09 2.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 106.588 -1.634 . . . . 0.0 106.588 168.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 72.5 t -64.84 131.34 30.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 123.451 0.7 . . . . 0.0 109.236 177.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 3.5 tpp180 62.81 45.78 5.5 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.786 1.235 . . . . 0.0 112.136 173.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.33 138.12 58.42 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.583 -0.698 . . . . 0.0 112.724 -169.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 51.8 mmm-85 -116.42 163.76 15.57 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 126.178 1.791 . . . . 0.0 110.39 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 33.2 mtm105 -55.39 -25.42 35.5 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 179.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -71.72 -18.82 62.12 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 174.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -79.72 -27.37 40.62 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 119.736 1.153 . . . . 0.0 112.329 177.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 50.8 m -49.47 139.79 11.53 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.822 1.249 . . . . 0.0 113.152 179.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 147.22 -167.15 28.47 Favored Glycine 0 N--CA 1.472 1.055 0 C-N-CA 124.535 1.064 . . . . 0.0 113.089 -174.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.7 m -91.93 148.17 22.41 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.996 1.318 . . . . 0.0 110.833 -177.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 65.7 m-85 -147.41 157.95 43.78 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.907 1.683 . . . . 0.0 112.083 -174.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -158.4 159.27 35.58 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.993 1.317 . . . . 0.0 113.492 175.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 49.7 t -104.03 148.6 26.03 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.257 1.823 . . . . 0.0 111.255 178.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -151.77 136.44 5.48 Favored Glycine 0 N--CA 1.474 1.179 0 C-N-CA 123.743 0.687 . . . . 0.0 114.308 177.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -113.84 155.68 25.27 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.74 1.216 . . . . 0.0 113.046 -176.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 18.5 tt -146.51 132.79 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 125.316 1.446 . . . . 0.0 110.436 172.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 16.4 m -72.46 161.13 31.23 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.529 1.131 . . . . 0.0 112.954 -178.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.58 -10.13 49.09 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 115.946 1.832 . . . . 0.0 115.946 -178.515 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -71.52 147.55 92.53 Favored Pre-proline 0 CA--C 1.549 0.926 0 C-N-CA 124.241 1.016 . . . . 0.0 112.303 -178.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -67.57 -21.89 45.34 Favored 'Trans proline' 0 CA--C 1.538 0.725 0 C-N-CA 122.982 2.455 . . . . 0.0 112.807 177.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -85.99 -0.82 56.45 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 124.874 1.269 . . . . 0.0 113.893 176.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.9 157.17 31.33 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.245 1.018 . . . . 0.0 113.094 -177.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 84.6 mt-30 -138.0 158.62 43.96 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.118 1.767 . . . . 0.0 108.916 175.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 57.9 mt -78.23 118.27 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 121.745 -0.597 . . . . 0.0 110.578 -175.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 3.8 ttmp? -94.19 131.43 39.76 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.272 1.429 . . . . 0.0 109.12 169.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -114.51 149.74 35.94 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.18 0.992 . . . . 0.0 112.504 -170.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 51.7 m -88.37 164.97 15.27 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.295 1.438 . . . . 0.0 113.132 174.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -66.7 139.52 57.84 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.566 0.746 . . . . 0.0 109.408 168.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.55 166.62 23.29 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 -173.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -142.28 169.6 17.27 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 127.227 2.211 . . . . 0.0 110.668 172.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -116.74 144.69 44.15 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 174.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 66.9 tp -102.67 135.91 43.44 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 127.141 2.176 . . . . 0.0 109.224 169.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 35.3 ttm180 -131.6 108.54 9.6 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.339 1.456 . . . . 0.0 109.503 -179.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 35.9 t -99.82 115.22 40.35 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 124.198 0.999 . . . . 0.0 109.064 176.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 82.8 p -97.03 154.88 17.05 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.891 1.676 . . . . 0.0 110.664 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -63.09 142.49 58.36 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.304 0.642 . . . . 0.0 112.455 -176.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 48.7 ttt85 -77.93 102.08 7.15 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 123.87 0.868 . . . . 0.0 110.826 -179.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.93 147.87 49.11 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.462 1.105 . . . . 0.0 112.79 -179.618 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -68.98 151.77 46.11 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.8 0.84 . . . . 0.0 112.351 174.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 . . . . . 0 C--O 1.253 1.284 0 C-N-CA 124.978 1.311 . . . . 0.0 113.201 177.868 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 1.7 mpt? . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 116.657 -1.64 . . . . 0.0 111.395 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -68.62 152.77 74.42 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 CA-C-N 122.247 1.838 . . . . 0.0 110.643 172.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -60.91 138.81 81.38 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 123.051 2.5 . . . . 0.0 114.986 -175.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.1 t -162.56 141.39 8.93 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 125.587 1.555 . . . . 0.0 111.055 169.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -120.7 114.27 21.42 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 126.079 1.752 . . . . 0.0 106.819 171.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 67.6 m -130.94 151.99 79.89 Favored Pre-proline 0 N--CA 1.475 0.811 0 N-CA-C 114.144 1.165 . . . . 0.0 114.144 -169.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -68.55 152.52 89.0 Favored 'Cis proline' 0 C--N 1.353 0.779 0 CA-C-N 118.79 0.604 . . . . 0.0 111.257 -4.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -55.94 -28.63 57.76 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 176.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 45.1 tp -137.16 114.46 10.88 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.46 1.504 . . . . 0.0 108.302 168.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 44.7 tp -96.74 126.62 42.03 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.96 1.304 . . . . 0.0 109.187 173.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.7 t -111.77 122.84 66.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 124.142 0.977 . . . . 0.0 108.472 172.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 33.6 m -126.54 167.98 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 124.347 1.059 . . . . 0.0 111.997 174.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 22.7 m -91.12 146.64 23.67 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.779 1.232 . . . . 0.0 110.128 172.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -52.41 120.15 5.25 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.469 1.108 . . . . 0.0 111.78 174.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 97.86 -1.58 59.71 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 126.083 1.801 . . . . 0.0 114.804 -177.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -89.62 155.06 19.49 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 119.556 1.678 . . . . 0.0 112.556 178.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 66.8 m-20 -83.21 106.08 14.71 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.012 0.925 . . . . 0.0 110.182 177.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -89.66 111.9 22.99 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.841 0.856 . . . . 0.0 110.872 -176.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 33.8 m -120.08 125.53 48.51 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.961 0.904 . . . . 0.0 111.496 -175.289 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -96.98 146.92 24.51 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 126.05 1.74 . . . . 0.0 110.684 170.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 88.4 m -94.17 123.92 37.86 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.003 1.321 . . . . 0.0 108.081 169.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 37.2 t -122.74 122.6 39.13 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.878 1.671 . . . . 0.0 109.774 -176.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 42.4 t -143.74 127.5 17.2 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 121.45 -0.781 . . . . 0.0 111.067 -169.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 33.6 p90 -160.59 149.88 17.2 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.472 1.509 . . . . 0.0 111.653 169.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 64.9 m -83.47 153.18 24.59 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.928 0.891 . . . . 0.0 112.278 171.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -130.26 147.29 51.97 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.353 1.461 . . . . 0.0 110.959 173.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 24.6 p -85.28 -17.33 37.25 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.646 1.578 . . . . 0.0 113.747 -176.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 18.8 p -80.93 163.96 22.95 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.94 1.696 . . . . 0.0 112.828 176.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -79.1 -18.01 54.09 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.887 1.675 . . . . 0.0 113.597 -178.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 25.1 m -167.48 147.97 5.35 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 126.526 1.93 . . . . 0.0 110.945 177.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 32.5 p90 -158.6 160.63 36.77 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.568 1.147 . . . . 0.0 112.85 -169.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 91.4 t -96.19 134.22 34.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 C-N-CA 126.216 1.806 . . . . 0.0 108.616 169.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -100.39 128.31 46.49 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.246 1.019 . . . . 0.0 108.427 168.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 28.3 m120 -120.48 157.14 30.03 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.513 1.925 . . . . 0.0 111.423 -176.076 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 17.1 t90 -135.03 143.76 46.92 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.32 1.048 . . . . 0.0 112.821 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -141.4 148.51 39.69 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.907 1.283 . . . . 0.0 114.097 -169.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 59.1 ttt85 -104.45 143.21 33.32 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.453 1.501 . . . . 0.0 108.172 167.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 33.8 mtp -86.49 145.07 26.96 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.354 0.979 . . . . 0.0 112.388 174.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 74.1 m -107.4 152.19 41.19 Favored Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 125.612 1.565 . . . . 0.0 111.478 177.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -68.57 -17.35 43.23 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 124.102 3.201 . . . . 0.0 113.608 -175.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.3 m -76.92 9.09 3.14 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.849 1.26 . . . . 0.0 113.005 171.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 58.9 t30 69.63 46.51 0.71 Allowed 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 127.402 2.281 . . . . 0.0 111.901 178.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -137.72 -172.61 3.28 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.077 1.351 . . . . 0.0 110.922 176.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.2 p -138.05 151.05 47.48 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 125.847 1.659 . . . . 0.0 110.474 -172.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -127.76 131.8 49.62 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 124.878 1.271 . . . . 0.0 111.224 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -78.44 118.84 20.98 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.316 1.447 . . . . 0.0 111.404 -172.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 86.1 mt -97.41 -51.12 4.27 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.773 1.229 . . . . 0.0 112.278 -170.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -168.51 171.32 9.04 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.748 1.619 . . . . 0.0 109.858 -174.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.51 163.06 35.54 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.803 1.241 . . . . 0.0 111.351 -176.276 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 38.9 t80 -138.07 116.22 9.54 Favored Pre-proline 0 CA--C 1.546 0.818 0 C-N-CA 124.032 0.933 . . . . 0.0 110.543 169.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -61.92 163.24 43.19 Favored 'Cis proline' 0 CA--C 1.539 0.765 0 CA-C-N 119.286 0.781 . . . . 0.0 111.379 -8.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -68.78 94.51 0.61 Allowed 'General case' 0 CA--C 1.543 0.707 0 CA-C-O 122.756 1.265 . . . . 0.0 112.373 -173.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -90.6 9.12 30.86 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 127.72 2.408 . . . . 0.0 113.369 -176.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 52.2 ptt85 -69.35 -29.27 67.03 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.331 1.052 . . . . 0.0 113.182 172.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 43.4 m 68.05 -25.16 0.13 Allowed 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 128.106 2.562 . . . . 0.0 115.573 175.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 57.8 mm-40 -135.83 164.08 45.89 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 127.055 2.142 . . . . 0.0 110.369 -176.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -77.07 176.38 10.2 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 123.578 2.852 . . . . 0.0 111.365 169.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 123.04 -11.89 8.65 Favored Glycine 0 CA--C 1.533 1.194 0 C-N-CA 124.968 1.27 . . . . 0.0 114.79 176.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 11.9 mp0 -86.82 147.95 25.6 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 118.191 0.995 . . . . 0.0 109.682 169.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -76.59 148.55 36.93 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 123.712 0.805 . . . . 0.0 113.064 -175.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 17.4 m -59.66 -16.33 25.67 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.53 1.532 . . . . 0.0 114.848 -178.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 66.2 mtt85 -52.01 -48.68 64.35 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.998 1.319 . . . . 0.0 113.792 171.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -83.08 132.37 35.12 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 -165.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -143.82 141.31 30.31 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.384 1.474 . . . . 0.0 111.746 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 89.8 t -123.72 129.1 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 C-N-CA 125.552 1.541 . . . . 0.0 109.065 170.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 89.0 m -129.86 131.44 46.1 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.155 1.382 . . . . 0.0 110.074 -179.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -82.93 135.92 34.74 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.947 0.899 . . . . 0.0 110.359 173.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 33.2 mt -88.31 163.02 38.25 Favored Pre-proline 0 CA--C 1.547 0.842 0 C-N-CA 123.569 0.748 . . . . 0.0 111.987 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.74 -22.93 38.83 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 123.996 3.131 . . . . 0.0 114.009 170.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 58.5 t30 -65.14 -12.19 48.3 Favored 'General case' 0 CA--C 1.555 1.173 0 C-N-CA 124.26 1.024 . . . . 0.0 113.445 175.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 78.25 -34.11 1.76 Allowed Glycine 0 N--CA 1.476 1.351 0 C-N-CA 127.677 2.56 . . . . 0.0 116.352 168.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 2.5 ppt_? -130.13 73.47 1.53 Allowed 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 123.512 1.625 . . . . 0.0 108.32 171.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 11.1 t0 179.76 136.91 0.11 Allowed 'General case' 0 C--O 1.238 0.485 0 C-N-CA 128.515 2.726 . . . . 0.0 108.415 -169.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -145.85 148.51 32.95 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 124.222 1.009 . . . . 0.0 112.35 -168.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 14.2 m170 -105.68 123.59 48.17 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.079 1.352 . . . . 0.0 111.099 169.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -110.96 111.3 22.33 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 126.813 2.045 . . . . 0.0 108.01 -178.106 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 8.4 t -123.7 134.3 53.73 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 115.317 1.599 . . . . 0.0 115.317 -168.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 25.7 t -99.33 93.57 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 126.42 1.888 . . . . 0.0 106.153 167.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 98.0 t -66.9 127.23 28.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 124.882 1.273 . . . . 0.0 109.536 178.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 68.8 ttt180 57.65 55.68 5.4 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.767 1.627 . . . . 0.0 111.653 178.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -72.56 140.53 48.15 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.001 0.92 . . . . 0.0 112.616 -172.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 60.6 mtp85 -129.32 168.53 16.11 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.766 1.626 . . . . 0.0 110.26 -174.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 51.5 mtm180 -61.84 -17.58 56.88 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 115.598 1.703 . . . . 0.0 115.598 -169.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -71.37 -22.84 61.84 Favored 'General case' 0 CA--C 1.553 1.064 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 169.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 -86.55 -13.54 45.56 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 125.377 1.471 . . . . 0.0 113.574 -176.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 41.4 m -55.61 137.82 48.29 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 120.986 -1.071 . . . . 0.0 111.183 169.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 151.61 -165.98 30.65 Favored Glycine 0 N--CA 1.471 0.97 0 O-C-N 121.445 -0.785 . . . . 0.0 113.504 -176.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.9 m -98.5 140.83 32.16 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.879 1.272 . . . . 0.0 110.895 -172.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -140.26 154.12 46.75 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.084 1.354 . . . . 0.0 112.568 -175.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.3 pp -158.35 153.99 26.32 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.944 1.298 . . . . 0.0 112.778 179.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 14.4 m -95.47 159.91 14.77 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.604 0.761 . . . . 0.0 112.121 172.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -143.8 175.26 23.82 Favored Glycine 0 CA--C 1.527 0.823 0 C-N-CA 125.35 1.452 . . . . 0.0 111.56 168.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -158.54 159.24 35.33 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 118.635 1.217 . . . . 0.0 113.96 -178.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 16.9 tt -150.22 138.94 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 125.417 1.487 . . . . 0.0 110.564 177.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 13.5 m -69.51 159.67 32.88 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.321 1.048 . . . . 0.0 112.668 176.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 40.9 mt -75.17 -11.87 60.17 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 177.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -65.59 148.78 97.93 Favored Pre-proline 0 CA--C 1.552 1.029 0 C-N-CA 124.405 1.082 . . . . 0.0 112.367 175.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -69.47 -20.19 36.55 Favored 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 123.141 2.561 . . . . 0.0 113.194 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -87.23 3.64 45.75 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.715 1.206 . . . . 0.0 113.886 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -67.31 164.56 18.18 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.871 1.268 . . . . 0.0 113.957 -175.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 22.1 pt20 -149.1 163.5 37.4 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.417 1.887 . . . . 0.0 109.756 176.28 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 54.8 mt -83.83 135.78 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 CA-C-O 121.554 0.693 . . . . 0.0 112.744 -171.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -95.99 144.67 26.08 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 127.502 2.321 . . . . 0.0 109.74 167.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.9 mp0 -143.03 158.82 43.24 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 126.543 1.937 . . . . 0.0 109.801 170.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 4.1 t -150.08 -170.35 3.62 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 175.07 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -61.5 130.68 47.17 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.13 1.772 . . . . 0.0 114.109 -169.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.73 167.18 22.31 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 115.872 1.804 . . . . 0.0 115.872 -169.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -123.27 169.67 11.06 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 127.33 2.252 . . . . 0.0 110.812 169.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -126.64 143.97 51.06 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.994 1.318 . . . . 0.0 111.846 -177.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 49.8 tp -114.08 136.7 52.64 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 126.354 1.861 . . . . 0.0 110.293 173.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 59.6 ttt85 -127.49 123.37 35.78 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 126.171 1.788 . . . . 0.0 109.944 170.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 44.9 t -102.96 123.57 56.45 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 124.612 1.165 . . . . 0.0 108.679 169.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 79.6 p -99.77 158.64 15.64 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.744 1.618 . . . . 0.0 110.882 176.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -58.52 150.85 21.69 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.421 1.088 . . . . 0.0 112.894 -178.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 11.9 ttm180 -69.7 126.46 29.78 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 123.695 0.798 . . . . 0.0 109.982 -174.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 64.0 mtt-85 -77.15 155.5 32.27 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.188 0.995 . . . . 0.0 112.624 -168.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -70.25 154.36 42.0 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.497 1.119 . . . . 0.0 112.509 175.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 . . . . . 0 C--O 1.253 1.259 0 C-N-CA 125.224 1.41 . . . . 0.0 112.965 177.267 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 27.8 ttt . . . . . 0 N--CA 1.488 1.437 0 CA-C-O 118.549 -0.739 . . . . 0.0 110.37 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -68.9 151.86 73.75 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 122.847 2.365 . . . . 0.0 111.216 177.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -68.48 123.27 10.32 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 123.469 2.779 . . . . 0.0 110.07 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 33.7 m -128.05 147.37 50.52 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.317 1.447 . . . . 0.0 109.661 -174.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -143.28 117.91 9.81 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.671 1.589 . . . . 0.0 109.043 179.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 88.6 p -140.94 159.89 60.36 Favored Pre-proline 0 CA--C 1.551 0.994 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 -168.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.3 162.51 79.31 Favored 'Cis proline' 0 C--N 1.356 0.925 0 CA-C-N 120.058 1.057 . . . . 0.0 111.912 -3.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.74 -24.05 67.61 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 177.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 47.9 tp -142.0 124.15 15.49 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 125.341 1.457 . . . . 0.0 108.658 169.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 53.7 tp -111.25 126.57 55.02 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.064 1.346 . . . . 0.0 109.255 171.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.2 t -111.51 122.57 66.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.966 0.907 . . . . 0.0 109.252 175.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.1 m -126.63 173.24 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 125.132 1.373 . . . . 0.0 111.342 170.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 99.1 m -104.84 151.79 23.4 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.49 1.516 . . . . 0.0 110.228 172.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -51.77 125.56 15.38 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.281 1.032 . . . . 0.0 112.562 174.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.84 -3.46 74.07 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 126.054 1.788 . . . . 0.0 114.531 -176.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -92.61 154.37 18.43 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 119.594 1.697 . . . . 0.0 111.523 175.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -85.17 127.39 34.25 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 121.505 0.669 . . . . 0.0 111.305 171.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -103.83 128.13 51.29 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.737 1.615 . . . . 0.0 110.083 178.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 27.7 m -128.66 127.87 43.02 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.064 0.945 . . . . 0.0 111.371 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -103.28 158.83 16.05 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.553 1.941 . . . . 0.0 110.59 170.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 85.5 m -101.2 134.21 44.59 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.058 1.343 . . . . 0.0 109.261 169.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 44.8 t -115.16 134.06 55.49 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.432 1.893 . . . . 0.0 110.011 170.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 66.8 m -138.69 130.34 27.63 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.194 0.997 . . . . 0.0 111.042 -173.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 40.9 p90 -160.6 153.01 20.59 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.494 1.518 . . . . 0.0 110.535 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 31.1 p -93.42 152.87 18.83 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.261 0.624 . . . . 0.0 111.042 168.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 -152.45 140.06 19.78 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.086 0.954 . . . . 0.0 111.625 -177.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 52.7 m -132.12 106.56 8.06 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.404 1.481 . . . . 0.0 108.145 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 29.6 t -177.26 169.73 2.23 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.422 1.889 . . . . 0.0 110.394 -172.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -76.52 -19.71 57.67 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 123.787 0.835 . . . . 0.0 112.061 168.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.8 m -175.52 163.5 2.96 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 127.538 2.335 . . . . 0.0 112.227 179.089 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 40.8 p90 -148.59 162.53 39.49 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.045 1.338 . . . . 0.0 111.924 -177.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 87.7 t -111.03 128.43 67.48 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 C-N-CA 125.612 1.565 . . . . 0.0 108.075 169.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 58.8 tp -106.37 134.05 50.11 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 125.243 1.417 . . . . 0.0 108.883 169.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -127.16 150.47 49.49 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.152 1.381 . . . . 0.0 110.825 178.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 11.7 t90 -117.62 139.99 50.24 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.473 1.109 . . . . 0.0 111.236 176.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -133.29 146.86 51.77 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.703 1.201 . . . . 0.0 113.626 -172.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -111.07 138.67 47.19 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.608 1.563 . . . . 0.0 108.276 168.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 28.3 mtp -85.05 143.62 28.77 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 118.846 0.748 . . . . 0.0 112.339 -178.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.4 m -100.43 154.05 37.41 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 125.212 1.405 . . . . 0.0 111.918 178.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.83 -30.98 79.17 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 124.442 3.428 . . . . 0.0 114.704 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.0 m -77.0 10.74 2.13 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.079 1.352 . . . . 0.0 113.593 178.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 66.38 43.6 2.63 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.775 2.03 . . . . 0.0 111.353 -176.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 -121.55 -172.73 2.48 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.551 1.541 . . . . 0.0 109.88 175.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.1 p -144.74 144.23 31.09 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.638 1.575 . . . . 0.0 110.609 -173.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -121.54 132.43 54.7 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.721 1.208 . . . . 0.0 111.347 176.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -77.66 128.27 33.82 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.866 1.266 . . . . 0.0 111.335 -177.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 60.0 mt -104.7 -44.5 4.85 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.196 1.398 . . . . 0.0 113.544 -168.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -171.27 174.93 4.38 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 128.085 2.554 . . . . 0.0 109.395 -174.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.403 ' HB2' ' H ' ' A' ' 85' ' ' ASP . . . -159.6 166.57 30.45 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.314 1.046 . . . . 0.0 112.769 -170.229 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -142.89 115.25 6.03 Favored Pre-proline 0 CA--C 1.546 0.821 0 C-N-CA 125.435 1.494 . . . . 0.0 109.67 169.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -55.12 153.4 20.94 Favored 'Cis proline' 0 C--N 1.351 0.705 0 CA-C-N 119.941 1.015 . . . . 0.0 112.665 -10.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -67.63 118.59 11.12 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 123.426 0.691 . . . . 0.0 112.387 -175.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.403 ' H ' ' HB2' ' A' ' 81' ' ' ALA . 74.9 m-20 -94.48 19.24 9.96 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 126.475 1.91 . . . . 0.0 112.176 178.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 78.6 mtp180 -57.66 -7.87 0.77 Allowed 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 127.205 2.202 . . . . 0.0 116.616 -168.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 21.3 m -67.03 -22.13 65.89 Favored 'General case' 0 CA--C 1.546 0.801 0 O-C-N 121.068 -1.02 . . . . 0.0 112.691 168.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 64.5 mm-40 -88.74 143.12 31.31 Favored Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 124.454 1.102 . . . . 0.0 111.432 176.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -76.15 159.56 37.07 Favored 'Trans proline' 0 C--N 1.35 0.655 0 C-N-CA 123.756 2.971 . . . . 0.0 113.089 -171.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 101.52 -20.71 45.49 Favored Glycine 0 N--CA 1.471 1.017 0 C-N-CA 126.126 1.822 . . . . 0.0 112.062 -179.019 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -81.27 149.28 29.05 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.911 1.284 . . . . 0.0 111.204 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -142.93 144.51 32.43 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.818 1.247 . . . . 0.0 111.477 -169.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 56.0 p -67.91 -14.93 63.36 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 115.027 1.491 . . . . 0.0 115.027 -174.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 13.0 ptp180 -65.26 -24.65 67.38 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 119.305 0.957 . . . . 0.0 112.725 173.176 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -93.99 140.02 30.22 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.32 1.448 . . . . 0.0 111.339 -176.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -137.86 145.27 41.99 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.298 1.439 . . . . 0.0 111.123 178.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 58.1 t -126.54 125.23 66.87 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 125.538 1.535 . . . . 0.0 108.734 174.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 84.8 m -130.49 129.28 42.72 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.818 1.247 . . . . 0.0 110.655 -174.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.7 pm0 -76.61 141.32 41.1 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.792 1.237 . . . . 0.0 111.605 175.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 38.0 mt -93.92 157.82 37.34 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 123.829 0.852 . . . . 0.0 111.628 177.061 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -65.71 -3.56 8.24 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 123.551 2.834 . . . . 0.0 114.028 174.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -62.41 -26.14 68.33 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 119.441 1.018 . . . . 0.0 112.739 169.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 92.34 -15.7 61.6 Favored Glycine 0 N--CA 1.474 1.226 0 C-N-CA 125.659 1.599 . . . . 0.0 114.547 175.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.41 73.51 0.91 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.769 1.628 . . . . 0.0 109.995 170.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -174.64 147.43 1.06 Allowed 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 127.223 2.209 . . . . 0.0 109.054 -177.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 60.6 m-85 -143.62 151.29 39.96 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 114.103 1.149 . . . . 0.0 114.103 -168.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 13.5 m170 -110.01 139.32 45.25 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.684 1.594 . . . . 0.0 109.625 167.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 46.1 mtt -128.84 123.73 33.53 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.896 1.278 . . . . 0.0 109.212 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 88.9 p -130.48 139.12 50.54 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 115.739 1.755 . . . . 0.0 115.739 -168.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 15.5 t -98.11 104.02 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 125.922 1.689 . . . . 0.0 106.656 169.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 60.7 t -81.48 128.67 38.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 123.647 0.779 . . . . 0.0 109.868 -176.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 50.1 ttt85 56.23 53.62 8.7 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.224 1.41 . . . . 0.0 111.017 178.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.43 145.83 55.64 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.614 1.166 . . . . 0.0 112.106 -170.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 33.8 mmm-85 -118.92 168.05 11.15 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.884 1.674 . . . . 0.0 110.489 178.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 44.3 mtm180 -57.78 -20.54 36.08 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 120.862 -1.149 . . . . 0.0 113.738 173.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -59.57 -22.86 62.34 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.248 1.419 . . . . 0.0 113.893 168.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -94.92 -13.28 25.54 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.214 1.406 . . . . 0.0 114.435 -175.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 67.2 m -60.71 134.89 57.53 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-N 120.349 1.431 . . . . 0.0 112.616 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 155.92 -165.78 32.76 Favored Glycine 0 N--CA 1.473 1.139 0 O-C-N 121.247 -0.908 . . . . 0.0 113.571 -177.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.0 m -95.98 139.61 31.93 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.501 1.12 . . . . 0.0 110.747 -177.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 61.3 m-85 -137.41 156.39 48.25 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.074 1.75 . . . . 0.0 112.558 -176.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -161.96 147.85 13.39 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.797 1.639 . . . . 0.0 112.134 176.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 24.7 p -94.46 159.16 15.23 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.698 0.799 . . . . 0.0 112.655 169.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -148.07 131.48 3.84 Favored Glycine 0 CA--C 1.529 0.91 0 C-N-CA 124.766 1.174 . . . . 0.0 112.639 173.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -115.11 147.41 40.26 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.563 1.145 . . . . 0.0 112.634 -176.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 18.6 tt -148.14 136.38 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 125.189 1.396 . . . . 0.0 111.007 178.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 31.5 m -72.15 155.38 40.32 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 121.101 -0.999 . . . . 0.0 111.853 174.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.68 -10.78 58.34 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 115.775 1.769 . . . . 0.0 115.775 -174.708 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -75.27 140.63 73.0 Favored Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 124.137 0.975 . . . . 0.0 111.935 179.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -55.28 -23.43 37.39 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 123.875 3.05 . . . . 0.0 114.797 174.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -71.2 -13.91 62.08 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 124.968 1.307 . . . . 0.0 114.099 177.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -74.73 161.47 29.6 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.24 1.416 . . . . 0.0 113.839 -176.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 28.5 mp0 -132.41 156.99 45.68 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.379 1.872 . . . . 0.0 108.573 170.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 33.7 mt -75.91 116.38 18.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 O-C-N 121.731 -0.606 . . . . 0.0 109.98 178.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.3 88.47 4.94 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.026 0.93 . . . . 0.0 109.358 169.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -77.38 131.32 37.99 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.466 1.106 . . . . 0.0 110.911 179.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 76.8 p -81.42 166.91 19.97 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 115.333 1.605 . . . . 0.0 115.333 -174.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 10.1 mp -67.29 114.5 6.05 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.103 0.961 . . . . 0.0 109.271 171.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.06 150.89 44.44 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -173.025 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -131.83 169.65 15.95 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 126.422 1.889 . . . . 0.0 112.442 178.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -110.89 139.66 46.03 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.078 1.351 . . . . 0.0 112.333 -177.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 59.6 tp -109.0 128.02 54.58 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 126.063 1.745 . . . . 0.0 108.938 168.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -118.77 117.01 27.74 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.494 1.518 . . . . 0.0 109.53 173.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 34.9 t -102.58 117.83 48.55 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 C-N-CA 124.347 1.059 . . . . 0.0 108.563 169.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 81.6 p -95.96 156.95 16.12 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.895 1.678 . . . . 0.0 111.304 -178.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -59.05 142.32 51.65 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.45 1.1 . . . . 0.0 113.224 -171.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -67.42 118.12 10.32 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 172.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 32.7 ptt-85 -139.78 167.61 21.71 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.418 1.087 . . . . 0.0 112.638 -168.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -72.75 154.31 40.73 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.526 1.13 . . . . 0.0 112.433 175.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 . . . . . 0 C--O 1.254 1.327 0 C-N-CA 125.224 1.41 . . . . 0.0 113.001 177.1 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 10.7 tpt . . . . . 0 N--CA 1.488 1.463 0 CA-C-O 117.822 -1.085 . . . . 0.0 110.06 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -59.39 -49.59 10.31 Favored 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 123.339 2.693 . . . . 0.0 115.068 -177.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -79.69 162.37 24.35 Favored 'Trans proline' 0 C--N 1.355 0.918 0 C-N-CA 122.37 2.047 . . . . 0.0 111.881 170.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 6.4 t -154.73 163.23 40.56 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.091 0.957 . . . . 0.0 112.206 173.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -148.07 116.74 6.66 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.997 2.119 . . . . 0.0 109.232 -175.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 73.0 m -140.82 160.65 57.77 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 124.621 1.168 . . . . 0.0 113.17 -169.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -71.53 156.34 97.09 Favored 'Cis proline' 0 C--N 1.352 0.75 0 CA-C-N 119.535 0.87 . . . . 0.0 111.305 -5.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.44 -20.09 64.16 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 176.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 36.2 tp -141.9 120.16 12.25 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.642 1.577 . . . . 0.0 108.874 169.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 62.1 tp -109.92 122.36 47.36 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.156 1.382 . . . . 0.0 108.98 169.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.2 t -106.25 123.8 61.2 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 172.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.5 m -128.05 176.23 8.1 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 124.828 1.251 . . . . 0.0 111.092 171.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 52.7 m -110.12 151.5 27.16 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.605 1.562 . . . . 0.0 110.519 175.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -54.33 125.16 18.26 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.906 1.282 . . . . 0.0 112.201 178.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 97.3 -9.16 64.97 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 127.224 2.345 . . . . 0.0 114.301 -174.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -81.38 160.53 24.07 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 119.927 1.863 . . . . 0.0 112.547 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -91.88 111.34 22.84 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.473 1.109 . . . . 0.0 109.302 172.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -96.52 118.64 33.45 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.098 0.959 . . . . 0.0 111.143 -175.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 28.5 m -123.08 125.26 44.86 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.566 0.746 . . . . 0.0 112.13 -173.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -101.76 159.55 15.23 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.909 1.683 . . . . 0.0 110.755 169.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 21.0 m -110.67 128.91 55.89 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.179 1.392 . . . . 0.0 110.037 174.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 42.5 t -115.06 150.89 35.2 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.916 1.687 . . . . 0.0 111.67 171.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 62.0 p -148.28 143.86 27.23 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.254 -0.904 . . . . 0.0 111.362 169.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -130.84 156.2 45.42 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 126.251 1.82 . . . . 0.0 114.677 -176.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.6 t -133.9 133.63 41.7 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.486 1.515 . . . . 0.0 108.671 168.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -133.88 151.87 51.67 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.042 1.337 . . . . 0.0 111.664 -171.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 16.6 m -72.01 -34.92 69.24 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.439 1.496 . . . . 0.0 112.95 -173.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 5.3 t -97.64 -171.15 2.12 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.003 0.921 . . . . 0.0 113.234 -178.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -71.02 -20.3 62.41 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.638 1.575 . . . . 0.0 115.083 -168.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 8.5 t -167.14 173.5 9.05 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.375 1.47 . . . . 0.0 111.345 -175.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 55.0 p90 -159.51 154.74 25.25 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.783 1.233 . . . . 0.0 113.204 -175.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 75.9 t -96.12 133.72 36.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 C-N-CA 125.636 1.574 . . . . 0.0 107.302 168.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.5 tp -99.3 147.6 25.02 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.714 1.206 . . . . 0.0 110.123 174.143 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 23.0 m120 -136.21 154.3 50.97 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.745 1.618 . . . . 0.0 111.382 -176.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 12.6 t90 -129.84 137.9 50.7 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.425 1.09 . . . . 0.0 111.787 177.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -134.02 145.73 49.72 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 -174.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 56.7 ttt85 -101.92 142.03 33.85 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.26 1.424 . . . . 0.0 107.883 166.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 29.6 mtp -88.25 144.34 26.5 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 118.657 0.662 . . . . 0.0 112.54 175.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 74.3 m -106.45 149.47 38.35 Favored Pre-proline 0 CA--C 1.545 0.755 0 C-N-CA 125.43 1.492 . . . . 0.0 111.161 173.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -68.37 -15.86 42.73 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 124.016 3.144 . . . . 0.0 114.013 -173.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 18.4 m -76.94 8.96 3.24 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.813 1.245 . . . . 0.0 113.027 172.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 58.1 t30 70.53 45.75 0.59 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 127.693 2.397 . . . . 0.0 111.507 -177.555 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -128.93 -179.53 5.15 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.56 1.544 . . . . 0.0 110.368 -179.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.7 p -142.2 152.52 43.21 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 126.02 1.728 . . . . 0.0 110.503 -175.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -131.05 131.89 44.57 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.515 1.126 . . . . 0.0 111.177 174.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -77.69 121.23 23.72 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.473 1.109 . . . . 0.0 110.89 -178.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 48.0 mt -94.27 -45.01 7.69 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.476 1.51 . . . . 0.0 111.82 -173.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -168.35 175.64 6.29 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.497 1.919 . . . . 0.0 110.565 -171.059 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -158.41 165.8 33.78 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.435 1.494 . . . . 0.0 111.57 -175.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -153.06 117.11 2.82 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 124.233 1.013 . . . . 0.0 111.39 172.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.75 154.33 23.49 Favored 'Cis proline' 0 C--N 1.35 0.63 0 CA-C-N 119.665 0.916 . . . . 0.0 111.981 -12.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -72.59 94.65 1.73 Allowed 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 121.841 0.829 . . . . 0.0 111.091 178.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -78.58 -2.0 36.78 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.816 1.646 . . . . 0.0 114.249 -177.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.8 ptm180 -75.51 5.35 6.02 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.65 1.98 . . . . 0.0 115.082 -177.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.7 t 81.9 -42.45 0.15 Allowed 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 128.446 2.698 . . . . 0.0 113.134 175.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -109.33 109.51 60.33 Favored Pre-proline 0 CA--C 1.545 0.782 0 C-N-CA 124.781 1.233 . . . . 0.0 109.972 176.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -88.63 140.3 4.28 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 123.767 2.978 . . . . 0.0 111.754 -173.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 85.08 16.26 65.35 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 125.135 1.35 . . . . 0.0 113.257 170.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -71.48 -34.54 70.27 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 117.781 0.79 . . . . 0.0 113.043 -169.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -93.89 131.46 39.29 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.697 1.199 . . . . 0.0 110.914 172.431 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 54.2 p -90.57 -16.69 28.29 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 114.497 1.295 . . . . 0.0 114.497 -176.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 35.2 mtp-105 -97.07 -44.64 6.89 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.329 1.051 . . . . 0.0 113.187 -169.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 99.6 m-85 -97.52 116.25 29.37 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.856 1.263 . . . . 0.0 109.908 -178.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -130.37 141.25 50.57 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.714 1.205 . . . . 0.0 111.332 -172.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 47.5 t -126.53 125.93 68.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 C-N-CA 125.085 1.354 . . . . 0.0 109.706 178.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 87.3 m -130.54 131.29 44.98 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.925 1.29 . . . . 0.0 110.674 -176.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -79.66 140.76 36.94 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.923 0.889 . . . . 0.0 111.91 176.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 27.1 mt -95.1 157.1 37.05 Favored Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 125.586 1.554 . . . . 0.0 111.67 178.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -70.76 -2.76 11.41 Favored 'Trans proline' 0 CA--C 1.542 0.915 0 C-N-CA 123.619 2.88 . . . . 0.0 114.177 175.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -70.24 -8.95 54.17 Favored 'General case' 0 CA--C 1.555 1.141 0 N-CA-C 114.109 1.152 . . . . 0.0 114.109 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 108.03 -33.95 5.94 Favored Glycine 0 N--CA 1.476 1.336 0 C-N-CA 125.903 1.716 . . . . 0.0 116.443 168.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.49 73.28 0.9 Allowed 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.453 1.627 . . . . 0.0 110.224 169.599 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -157.45 142.37 16.79 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 125.171 1.389 . . . . 0.0 109.34 -167.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -149.45 135.17 18.65 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.056 0.542 . . . . 0.0 111.724 -169.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -90.99 136.25 33.2 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.022 0.929 . . . . 0.0 111.129 169.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 32.9 mtt -121.22 106.03 11.12 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 126.063 1.745 . . . . 0.0 109.38 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 33.8 t -110.98 128.88 55.98 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.257 1.023 . . . . 0.0 113.416 -169.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 28.2 t -96.88 100.85 11.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 C-N-CA 125.865 1.666 . . . . 0.0 106.61 168.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 89.0 t -73.96 129.23 36.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 124.09 0.956 . . . . 0.0 109.924 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 60.57 57.02 2.88 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.137 1.375 . . . . 0.0 110.967 173.577 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.78 156.31 39.46 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.338 1.055 . . . . 0.0 113.211 -171.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 23.6 mtm180 -133.66 160.68 36.81 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 126.533 1.933 . . . . 0.0 109.716 -168.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 32.2 mtp85 -55.65 -27.49 50.15 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 120.03 1.286 . . . . 0.0 113.258 171.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -69.89 -20.67 63.37 Favored 'General case' 0 CA--C 1.553 1.084 0 N-CA-C 114.476 1.287 . . . . 0.0 114.476 172.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -83.24 -9.81 58.92 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 121.061 -1.024 . . . . 0.0 112.879 175.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 71.2 m -59.88 135.6 57.75 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 120.211 -1.555 . . . . 0.0 111.634 173.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 160.27 -172.75 36.77 Favored Glycine 0 CA--C 1.53 1.028 0 C-N-CA 124.529 1.062 . . . . 0.0 113.365 -179.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.0 m -91.13 140.92 29.36 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.802 0.841 . . . . 0.0 109.985 176.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 52.9 m-85 -133.82 160.17 38.44 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.232 1.813 . . . . 0.0 110.632 178.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -155.99 149.54 24.85 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 124.299 1.04 . . . . 0.0 112.684 175.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 36.7 t -89.57 158.64 17.56 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.149 1.38 . . . . 0.0 111.054 173.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -149.32 170.43 29.59 Favored Glycine 0 N--CA 1.471 1.026 0 C-N-CA 125.634 1.587 . . . . 0.0 112.282 174.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -156.68 159.21 38.17 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 173.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 21.0 tt -140.8 135.6 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 125.846 1.658 . . . . 0.0 109.934 174.253 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 19.9 m -69.31 160.79 30.59 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.515 0.726 . . . . 0.0 112.821 -179.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.53 -15.88 63.73 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 115.421 1.637 . . . . 0.0 115.421 -173.518 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -78.68 149.09 74.06 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 124.776 1.23 . . . . 0.0 112.445 -177.253 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -67.68 -22.48 43.73 Favored 'Trans proline' 0 CA--C 1.54 0.775 0 C-N-CA 123.125 2.55 . . . . 0.0 113.09 -179.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -79.19 -2.95 43.34 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 114.687 1.365 . . . . 0.0 114.687 176.199 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.46 167.71 16.07 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.769 1.228 . . . . 0.0 113.319 -178.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 22.3 pt20 -146.8 161.3 40.96 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.207 1.803 . . . . 0.0 109.312 173.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 20.9 mt -77.65 118.9 25.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 O-C-N 121.609 -0.682 . . . . 0.0 111.126 -174.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -89.76 128.14 36.07 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.313 1.445 . . . . 0.0 109.426 168.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -87.12 145.39 26.46 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.347 1.059 . . . . 0.0 110.861 178.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 5.8 t -94.36 -166.8 1.55 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.44 1.096 . . . . 0.0 112.237 172.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -68.02 153.01 44.64 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.33 1.452 . . . . 0.0 111.676 174.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 25.7 mtp-105 -91.15 146.51 23.77 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 125.346 1.458 . . . . 0.0 110.906 172.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -143.0 150.03 39.09 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.269 1.427 . . . . 0.0 111.837 178.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -93.0 132.49 37.04 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.599 1.16 . . . . 0.0 111.818 177.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 48.1 tp -103.63 126.33 50.71 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 166.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 33.6 ttm180 -128.38 109.94 11.89 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 124.342 1.057 . . . . 0.0 109.01 -178.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 21.8 t -102.32 119.53 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 123.872 0.869 . . . . 0.0 108.727 178.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 70.1 p -93.36 147.72 22.68 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 126.064 1.746 . . . . 0.0 109.887 178.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 10.6 pm0 -57.43 150.23 19.02 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.741 0.817 . . . . 0.0 112.592 -179.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 47.2 ttt85 -64.93 116.55 6.49 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 124.079 0.952 . . . . 0.0 110.918 -168.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 18.6 ptp180 -71.09 157.73 37.69 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.995 0.918 . . . . 0.0 113.37 -169.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -70.71 154.36 41.93 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.346 1.058 . . . . 0.0 112.367 174.238 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 . . . . . 0 C--O 1.252 1.196 0 C-N-CA 125.07 1.348 . . . . 0.0 113.314 177.772 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 97.0 mmm . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 118.354 -0.831 . . . . 0.0 110.762 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_exo -58.4 -46.38 24.92 Favored 'Trans proline' 0 CA--C 1.545 1.027 0 C-N-CA 123.688 2.925 . . . . 0.0 116.137 -177.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -81.69 160.26 19.09 Favored 'Trans proline' 0 C--N 1.356 0.966 0 C-N-CA 122.374 2.05 . . . . 0.0 112.158 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.2 t -158.58 158.13 33.31 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.359 1.063 . . . . 0.0 112.126 176.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -144.97 115.31 7.56 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 126.415 1.886 . . . . 0.0 108.493 175.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 93.3 p -140.88 159.31 62.72 Favored Pre-proline 0 CA--C 1.55 0.954 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 -168.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -69.84 161.6 86.1 Favored 'Cis proline' 0 C--N 1.354 0.867 0 CA-C-N 119.488 0.853 . . . . 0.0 111.6 -6.088 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.68 -24.49 67.8 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.148 0.795 . . . . 0.0 113.148 176.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 46.4 tp -141.0 121.26 13.89 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.639 1.576 . . . . 0.0 108.784 169.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 57.0 tp -107.17 125.45 51.11 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.241 1.417 . . . . 0.0 109.078 171.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.4 t -109.61 123.54 65.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.089 0.956 . . . . 0.0 108.702 173.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 26.8 m -127.42 164.38 28.53 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 124.707 1.203 . . . . 0.0 111.451 172.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 51.9 m -90.66 149.43 22.09 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.272 1.029 . . . . 0.0 110.451 171.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -56.98 123.66 15.93 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.117 0.967 . . . . 0.0 111.834 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 87.92 3.53 79.83 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 126.106 1.812 . . . . 0.0 114.569 -175.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -92.27 157.6 16.57 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.487 1.644 . . . . 0.0 111.569 170.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -82.45 130.37 35.09 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.187 0.995 . . . . 0.0 110.635 177.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -112.9 124.72 53.25 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.787 1.235 . . . . 0.0 111.099 -178.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 28.4 m -129.76 125.4 35.75 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 119.184 0.902 . . . . 0.0 112.078 -176.437 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -100.41 151.26 21.74 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.697 1.599 . . . . 0.0 110.621 169.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 58.0 m -99.54 130.39 45.78 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.292 1.437 . . . . 0.0 109.112 173.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 44.5 t -125.06 143.51 50.88 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 126.242 1.817 . . . . 0.0 111.496 177.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 96.3 p -153.97 156.82 38.16 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.103 -0.998 . . . . 0.0 113.131 168.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -143.39 156.19 44.61 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.846 2.058 . . . . 0.0 111.25 178.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.6 t -84.6 101.44 12.13 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 166.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -124.8 145.36 49.79 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.483 1.513 . . . . 0.0 110.77 -177.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 24.0 m -57.17 139.26 53.11 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.66 1.584 . . . . 0.0 110.724 179.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.2 m -68.75 -2.23 8.85 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 115.184 1.55 . . . . 0.0 115.184 -172.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -78.2 -70.74 0.47 Allowed 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.179 1.392 . . . . 0.0 111.428 -178.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 82.2 p -171.38 150.64 2.91 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.515 1.126 . . . . 0.0 113.631 -176.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 34.7 p90 -169.11 164.36 11.22 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.191 1.796 . . . . 0.0 111.84 -176.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 21.4 t -107.83 134.1 50.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 125.848 1.659 . . . . 0.0 109.027 169.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -104.53 141.08 37.02 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.648 1.179 . . . . 0.0 109.282 168.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -137.7 158.04 45.2 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.471 1.508 . . . . 0.0 111.182 -170.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 10.0 t90 -129.09 138.02 51.59 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.417 1.087 . . . . 0.0 112.187 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -131.19 141.41 50.05 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.247 1.419 . . . . 0.0 112.977 -175.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 48.7 ttp180 -101.11 143.98 30.56 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.936 2.094 . . . . 0.0 108.718 169.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 36.8 mtp -93.65 141.86 28.0 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.854 0.752 . . . . 0.0 112.398 178.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.0 m -92.21 158.49 39.06 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 124.849 1.26 . . . . 0.0 111.709 175.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_exo -55.81 -33.44 88.2 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 123.949 3.099 . . . . 0.0 114.192 177.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 12.6 m -77.03 8.28 4.03 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.201 1.4 . . . . 0.0 113.821 177.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 60.3 t30 70.19 22.84 5.38 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 127.279 2.232 . . . . 0.0 113.259 -178.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 45.4 mt-30 -90.14 -176.73 4.95 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.423 1.089 . . . . 0.0 110.364 169.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.6 p -138.3 152.18 48.28 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.515 1.526 . . . . 0.0 111.165 -175.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -132.58 129.33 38.86 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 126.505 1.922 . . . . 0.0 110.155 -176.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 44.9 tttm -85.76 121.5 28.51 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.194 0.998 . . . . 0.0 111.252 -171.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 53.5 mt -97.6 -48.69 5.15 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.914 1.285 . . . . 0.0 113.124 -168.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -170.66 172.68 5.71 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.88 1.672 . . . . 0.0 110.972 -172.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.59 165.49 32.7 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.993 1.317 . . . . 0.0 112.629 -177.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -140.63 121.0 8.86 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 125.684 1.594 . . . . 0.0 109.822 170.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.23 154.16 17.59 Favored 'Cis proline' 0 C--N 1.351 0.694 0 CA-C-N 120.065 1.059 . . . . 0.0 112.96 -9.404 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -65.55 111.8 3.3 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.954 0.883 . . . . 0.0 112.739 -171.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -89.53 7.41 36.39 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.723 2.009 . . . . 0.0 112.882 177.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -55.54 -11.2 0.81 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 126.993 2.117 . . . . 0.0 116.458 -170.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 20.3 m -62.46 -25.22 67.87 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.628 1.171 . . . . 0.0 112.649 168.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -83.71 123.15 76.54 Favored Pre-proline 0 CA--C 1.549 0.923 0 CA-C-O 118.173 -0.918 . . . . 0.0 109.507 169.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -58.35 155.79 33.78 Favored 'Trans proline' 0 C--N 1.356 0.935 0 C-N-CA 124.239 3.293 . . . . 0.0 115.53 -173.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 102.04 -19.97 47.19 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 126.043 1.782 . . . . 0.0 112.036 -179.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -89.42 141.27 28.71 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.963 1.305 . . . . 0.0 111.282 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -143.05 176.86 8.77 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 114.474 1.287 . . . . 0.0 114.474 -172.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 50.7 p -83.99 -20.06 33.46 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 115.638 1.718 . . . . 0.0 115.638 -174.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 44.0 mtp-105 -69.26 -36.88 77.58 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 120.063 1.301 . . . . 0.0 111.995 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -92.46 130.4 38.14 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.978 1.311 . . . . 0.0 108.56 173.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -131.06 152.15 50.67 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.083 1.353 . . . . 0.0 111.374 -177.249 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 97.4 t -126.61 123.21 62.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 125.534 1.533 . . . . 0.0 108.88 175.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 95.8 m -122.77 126.95 48.47 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.326 1.05 . . . . 0.0 110.787 -177.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 3.2 tp-100 -76.18 134.72 39.83 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.645 1.578 . . . . 0.0 109.989 171.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 33.3 mt -90.29 164.39 27.62 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 124.054 0.942 . . . . 0.0 112.004 176.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -55.37 -21.28 28.93 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 123.872 3.048 . . . . 0.0 114.172 172.058 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -60.19 -26.16 66.14 Favored 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 176.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 89.84 -17.25 53.99 Favored Glycine 0 CA--C 1.535 1.32 0 C-N-CA 125.355 1.455 . . . . 0.0 114.602 173.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 5.3 ptt180 -152.44 73.54 1.03 Allowed 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 123.024 1.393 . . . . 0.0 109.178 169.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -169.92 137.54 1.65 Allowed 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 128.322 2.649 . . . . 0.0 107.304 -179.081 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -141.58 145.44 35.07 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 114.46 1.282 . . . . 0.0 114.46 -166.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 -102.53 121.22 41.94 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.044 1.338 . . . . 0.0 110.506 168.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -101.29 103.85 14.84 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 126.467 1.907 . . . . 0.0 107.948 176.369 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 14.8 m -114.52 121.88 44.84 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 114.136 1.162 . . . . 0.0 114.136 -167.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 12.8 t -88.59 118.04 33.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 C-N-CA 125.084 1.354 . . . . 0.0 107.509 168.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 98.0 t -78.86 117.31 24.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 124.25 1.02 . . . . 0.0 109.21 173.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 55.6 mtp180 48.37 76.92 0.11 Allowed 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 126.787 2.035 . . . . 0.0 111.876 178.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -69.77 138.17 52.53 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.422 1.089 . . . . 0.0 111.891 -176.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.78 161.16 17.88 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 126.235 1.814 . . . . 0.0 110.195 178.342 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 76.9 mtm180 -56.76 -23.07 40.28 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 114.387 1.255 . . . . 0.0 114.387 -178.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -65.16 -23.6 67.15 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 170.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -82.13 -16.84 48.52 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.226 1.01 . . . . 0.0 113.365 -178.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 49.8 m -59.59 134.67 57.23 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 119.743 1.156 . . . . 0.0 112.693 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 152.68 -169.12 31.75 Favored Glycine 0 N--CA 1.472 1.086 0 C-N-CA 124.812 1.196 . . . . 0.0 113.249 -174.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.0 m -93.12 147.49 22.82 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.314 1.046 . . . . 0.0 111.146 -178.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -141.52 159.49 42.1 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.804 2.041 . . . . 0.0 111.5 -177.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.0 pp -154.34 154.1 32.77 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.618 1.567 . . . . 0.0 111.152 172.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 29.5 p -102.13 157.7 16.7 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.305 0.642 . . . . 0.0 112.566 171.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -149.06 145.16 13.17 Favored Glycine 0 N--CA 1.472 1.075 0 C-N-CA 124.997 1.284 . . . . 0.0 113.89 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -125.38 159.26 32.25 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.971 1.309 . . . . 0.0 113.04 -173.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 16.9 tt -159.5 137.57 2.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 125.332 1.453 . . . . 0.0 111.176 178.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 17.8 m -70.92 161.45 31.03 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.143 0.977 . . . . 0.0 112.664 175.059 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 17.8 mt -77.04 -12.56 59.95 Favored 'General case' 0 N--CA 1.479 0.994 0 O-C-N 120.69 -1.256 . . . . 0.0 114.335 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -65.82 143.83 98.65 Favored Pre-proline 0 CA--C 1.552 1.041 0 C-N-CA 124.046 0.939 . . . . 0.0 112.377 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_exo -55.58 -27.67 61.21 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 123.782 2.988 . . . . 0.0 114.695 176.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -83.24 -1.61 53.56 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.719 1.208 . . . . 0.0 114.218 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -67.94 162.77 23.59 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.366 1.066 . . . . 0.0 113.474 -177.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.27 153.21 38.4 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.812 1.645 . . . . 0.0 108.814 178.004 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 64.9 mt -76.53 124.75 35.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 123.631 0.773 . . . . 0.0 111.828 -173.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -97.11 145.46 25.98 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.695 1.198 . . . . 0.0 108.116 165.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -130.16 148.96 52.05 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.461 1.028 . . . . 0.0 111.818 -179.059 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 4.9 t -94.51 -166.11 1.42 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.011 1.325 . . . . 0.0 113.126 -173.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 82.8 mt -64.68 155.3 33.93 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.615 1.566 . . . . 0.0 111.734 175.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 31.0 mtp-105 -89.38 139.22 30.73 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.548 1.139 . . . . 0.0 110.444 173.043 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -137.11 151.01 48.37 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.413 1.485 . . . . 0.0 111.419 178.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -103.85 137.76 41.4 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.428 1.091 . . . . 0.0 111.754 -177.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 63.1 tp -106.14 128.97 54.27 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 125.747 1.619 . . . . 0.0 108.905 169.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 71.4 ttt180 -120.52 118.24 29.71 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.516 1.527 . . . . 0.0 109.399 171.268 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 32.8 t -102.17 119.44 50.48 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 C-N-CA 124.494 1.118 . . . . 0.0 108.432 170.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 63.0 p -99.66 144.77 28.36 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.526 1.531 . . . . 0.0 110.078 179.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -62.82 145.07 55.86 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.795 -0.566 . . . . 0.0 112.459 -174.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 46.9 ttt85 -79.75 99.68 7.57 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.196 0.999 . . . . 0.0 110.857 -171.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -76.33 161.41 28.75 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.012 1.325 . . . . 0.0 113.077 -178.234 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -71.57 154.35 41.51 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.523 1.129 . . . . 0.0 112.489 175.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 . . . . . 0 C--O 1.253 1.242 0 C-N-CA 125.313 1.445 . . . . 0.0 112.6 176.475 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 55.8 tpp . . . . . 0 N--CA 1.486 1.374 0 CA-C-O 118.916 -0.564 . . . . 0.0 110.61 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -71.42 162.74 41.38 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 122.752 2.301 . . . . 0.0 110.501 170.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -52.19 131.69 40.58 Favored 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 123.571 2.847 . . . . 0.0 113.558 177.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.0 t -159.3 141.85 13.94 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 126.269 1.828 . . . . 0.0 109.957 173.206 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.407 ' CD1' ' SG ' ' A' ' 123' ' ' CYS . 1.4 m-85 -127.39 141.95 51.55 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.143 0.977 . . . . 0.0 112.048 -168.202 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 95.9 p -141.08 159.39 61.89 Favored Pre-proline 0 CA--C 1.548 0.9 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 177.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -73.15 161.54 93.69 Favored 'Cis proline' 0 C--N 1.353 0.802 0 CA-C-N 118.925 0.652 . . . . 0.0 111.096 -11.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.5 -29.44 70.55 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 171.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 49.1 tp -140.53 121.93 15.01 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.82 1.648 . . . . 0.0 109.453 171.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 56.5 tp -104.81 126.68 52.13 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.74 1.616 . . . . 0.0 109.068 171.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 18.3 t -110.18 125.45 67.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 123.999 0.92 . . . . 0.0 108.533 171.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.1 m -129.47 165.14 30.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 124.671 1.188 . . . . 0.0 111.653 174.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 88.5 m -92.12 148.6 22.05 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.295 1.038 . . . . 0.0 109.849 171.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -56.23 123.8 15.78 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.987 0.915 . . . . 0.0 112.076 -177.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 93.58 -2.98 71.03 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 125.421 1.486 . . . . 0.0 114.74 -175.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -71.16 153.24 42.65 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.624 1.712 . . . . 0.0 111.461 169.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -84.28 106.53 15.97 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 169.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -94.25 123.18 37.49 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.863 0.865 . . . . 0.0 110.928 -172.047 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 42.0 m -131.63 126.83 35.69 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 119.051 0.841 . . . . 0.0 112.313 -170.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -98.29 156.74 16.57 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 126.139 1.776 . . . . 0.0 110.506 170.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.8 m -105.64 129.74 53.82 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.834 1.254 . . . . 0.0 109.18 171.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 67.8 m -115.84 124.4 50.59 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.58 1.152 . . . . 0.0 109.104 169.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 73.1 m -121.55 126.37 49.0 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 124.748 1.219 . . . . 0.0 110.075 -170.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 10.9 p90 -160.53 156.3 25.61 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.961 1.304 . . . . 0.0 110.583 177.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 63.1 m -83.26 114.65 21.53 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.26 -0.9 . . . . 0.0 110.074 177.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -67.58 146.61 53.72 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.813 1.245 . . . . 0.0 111.534 -175.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 62.2 p -77.12 152.57 34.88 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.083 0.953 . . . . 0.0 111.514 -178.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 24.6 m -77.47 -24.29 50.24 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 177.041 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -90.31 -32.7 16.4 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.406 1.083 . . . . 0.0 112.949 -174.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 8.6 t 128.96 165.17 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 131.416 3.886 . . . . 0.0 112.168 175.357 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 53.1 p90 -157.12 169.0 25.78 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.022 1.729 . . . . 0.0 112.283 -168.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 17.6 t -125.42 133.68 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 125.744 1.617 . . . . 0.0 107.786 168.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -105.89 136.17 46.02 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.138 1.375 . . . . 0.0 108.913 173.552 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -126.82 150.96 48.92 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.119 1.367 . . . . 0.0 111.502 178.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 14.0 t90 -127.59 138.93 53.01 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.242 1.417 . . . . 0.0 111.847 178.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -134.74 151.31 50.88 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.612 1.565 . . . . 0.0 113.815 -171.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -112.08 141.19 46.07 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.556 1.542 . . . . 0.0 109.328 168.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 84.5 mmm -73.79 137.73 44.06 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.473 0.709 . . . . 0.0 111.642 174.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 67.7 m -94.26 156.6 38.68 Favored Pre-proline 0 CA--C 1.548 0.882 0 C-N-CA 124.723 1.209 . . . . 0.0 111.57 170.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -55.65 -32.74 84.76 Favored 'Trans proline' 0 C--N 1.354 0.857 0 C-N-CA 124.038 3.159 . . . . 0.0 114.648 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.3 m -76.99 5.73 7.52 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.804 1.241 . . . . 0.0 113.835 178.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 72.93 21.01 3.38 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 127.843 2.457 . . . . 0.0 112.98 -175.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -90.41 -175.08 4.36 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.589 1.156 . . . . 0.0 110.314 170.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.9 p -139.02 145.26 39.42 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 125.618 1.567 . . . . 0.0 110.024 -175.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -121.27 131.48 54.24 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.165 0.986 . . . . 0.0 111.193 176.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -80.97 123.07 28.03 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.237 1.415 . . . . 0.0 110.773 -175.012 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 45.5 mt -100.94 -53.54 3.02 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.864 1.266 . . . . 0.0 112.2 -168.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -161.16 167.28 26.46 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.273 1.829 . . . . 0.0 110.014 -169.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.63 166.85 29.8 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.974 0.91 . . . . 0.0 112.292 -172.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 74.1 t80 -144.99 114.57 4.99 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 124.511 1.124 . . . . 0.0 110.558 170.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -55.71 154.05 23.41 Favored 'Cis proline' 0 C--N 1.351 0.671 0 CA-C-N 119.772 0.954 . . . . 0.0 112.567 -11.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -68.17 110.76 4.15 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.74 0.781 . . . . 0.0 112.134 -177.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -83.83 -8.16 59.28 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.797 1.639 . . . . 0.0 113.468 176.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 39.3 ptt180 -90.85 10.38 26.46 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 126.789 2.035 . . . . 0.0 114.668 -174.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 44.7 m -74.6 58.15 0.77 Allowed 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 125.841 1.656 . . . . 0.0 113.771 -173.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 61.5 mm-40 -129.95 160.88 62.97 Favored Pre-proline 0 CA--C 1.547 0.859 0 C-N-CA 127.3 2.24 . . . . 0.0 109.492 176.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -52.26 138.63 55.03 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 123.701 2.934 . . . . 0.0 113.554 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 85.93 42.79 6.61 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 123.902 0.763 . . . . 0.0 112.96 -174.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -67.44 149.83 49.72 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.464 1.106 . . . . 0.0 112.387 -177.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -82.12 150.76 27.3 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.001 1.32 . . . . 0.0 112.741 173.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 9.1 t -110.03 -25.1 10.42 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.01 1.324 . . . . 0.0 114.132 176.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -76.84 -46.71 23.75 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 121.009 -1.057 . . . . 0.0 113.63 -170.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -95.8 140.94 29.86 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.427 1.091 . . . . 0.0 112.161 -168.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 58.9 ttt180 -144.54 147.27 33.01 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.11 1.364 . . . . 0.0 112.081 176.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 84.7 t -115.72 126.74 73.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 126.176 1.791 . . . . 0.0 108.763 170.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 98.5 m -130.51 132.29 45.55 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.361 1.464 . . . . 0.0 110.39 -177.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -77.68 138.47 39.09 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.09 0.556 . . . . 0.0 110.231 172.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 20.2 mt -76.85 156.44 82.55 Favored Pre-proline 0 CA--C 1.544 0.743 0 O-C-N 121.704 -0.622 . . . . 0.0 111.788 171.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -66.46 -6.4 15.03 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.504 2.802 . . . . 0.0 113.44 172.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -60.04 -26.09 65.85 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 124.086 0.955 . . . . 0.0 112.98 169.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 88.28 -10.58 70.69 Favored Glycine 0 CA--C 1.534 1.246 0 C-N-CA 125.079 1.323 . . . . 0.0 115.041 178.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 32.6 ptt180 -154.58 73.61 0.91 Allowed 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 118.76 1.28 . . . . 0.0 111.533 173.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -178.76 148.37 0.42 Allowed 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 128.157 2.583 . . . . 0.0 108.912 -177.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -138.01 146.6 43.27 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.793 0.837 . . . . 0.0 112.925 -177.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 6.6 m170 -109.2 131.26 55.24 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.033 1.733 . . . . 0.0 111.537 169.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -114.06 105.1 12.81 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 126.706 2.002 . . . . 0.0 107.762 -176.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 38.2 p -115.1 133.14 56.3 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 -168.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 15.4 t -96.25 104.71 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 126.772 2.029 . . . . 0.0 106.91 168.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 95.8 t -74.52 114.8 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 124.537 1.135 . . . . 0.0 108.742 177.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 10.1 mpt_? 55.34 84.96 0.07 Allowed 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 126.257 1.823 . . . . 0.0 111.317 -173.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -73.76 118.23 16.46 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.744 0.817 . . . . 0.0 111.213 178.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 9.4 mpt_? -85.82 159.86 19.61 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.41 1.484 . . . . 0.0 109.383 171.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 17.1 mmm180 -49.2 -39.17 28.53 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 120.937 -1.102 . . . . 0.0 113.011 172.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -67.36 -10.07 47.55 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 178.011 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -84.6 -8.45 58.89 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 120.107 1.321 . . . . 0.0 112.871 172.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.4 m -64.35 136.69 57.38 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 120.155 -1.59 . . . . 0.0 112.438 177.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 155.24 -166.74 32.72 Favored Glycine 0 N--CA 1.468 0.786 0 C-N-CA 124.101 0.858 . . . . 0.0 113.016 -178.462 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.0 m -97.26 140.42 31.77 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.525 1.13 . . . . 0.0 110.803 -176.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -135.73 163.0 31.17 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.3 1.84 . . . . 0.0 112.175 -177.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -162.13 146.62 12.46 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.568 1.547 . . . . 0.0 112.589 171.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . 0.407 ' SG ' ' CD1' ' A' ' 37' ' ' PHE . 1.8 p -108.54 170.69 7.86 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.038 1.735 . . . . 0.0 111.026 176.247 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -175.35 142.37 6.16 Favored Glycine 0 N--CA 1.471 1.026 0 O-C-N 121.237 -0.915 . . . . 0.0 114.184 177.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -109.73 148.2 31.84 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.567 1.147 . . . . 0.0 112.765 -176.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 21.3 tt -138.01 143.7 32.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 126.667 1.987 . . . . 0.0 110.078 177.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.7 m -67.5 161.56 25.2 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.871 0.868 . . . . 0.0 112.835 176.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -59.02 -25.74 63.94 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 115.223 1.564 . . . . 0.0 115.223 178.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -81.73 148.13 60.76 Favored Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 124.876 1.27 . . . . 0.0 112.52 -174.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -69.91 -24.97 28.4 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 123.261 2.64 . . . . 0.0 114.107 -171.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.3 -0.97 30.89 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.84 1.422 . . . . 0.0 114.84 178.517 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.79 173.95 5.71 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.512 1.525 . . . . 0.0 113.196 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 53.8 tp60 -134.99 143.84 47.05 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.114 1.766 . . . . 0.0 109.171 179.041 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 53.7 mt -72.45 114.84 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 170.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -85.13 112.74 20.96 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.396 1.079 . . . . 0.0 111.027 -178.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -90.67 158.88 16.68 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.033 1.733 . . . . 0.0 112.048 -177.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 4.9 t -145.98 -166.85 2.57 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.994 0.918 . . . . 0.0 111.799 169.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.88 136.55 57.03 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.727 1.211 . . . . 0.0 113.094 -172.685 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 80.0 mtt85 -72.43 146.33 47.03 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.709 0.804 . . . . 0.0 111.529 -177.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -120.78 135.58 55.12 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.064 1.745 . . . . 0.0 110.688 -176.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -104.42 139.28 39.59 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.341 1.056 . . . . 0.0 111.728 -175.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 52.5 tp -109.62 127.91 54.86 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.8 1.64 . . . . 0.0 109.659 171.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 60.7 ttt85 -118.25 119.29 34.21 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.678 1.591 . . . . 0.0 109.179 170.127 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 43.6 t -102.0 123.15 55.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 171.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 68.6 p -99.0 145.47 27.04 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.566 1.546 . . . . 0.0 109.208 175.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -66.43 141.81 57.8 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 121.54 -0.725 . . . . 0.0 111.754 -175.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -87.05 126.37 34.71 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.186 0.994 . . . . 0.0 110.598 -179.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 75.3 ttt180 -72.48 142.15 48.57 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.039 0.936 . . . . 0.0 111.438 -178.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -70.14 154.34 42.04 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.502 1.121 . . . . 0.0 112.828 177.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 . . . . . 0 C--O 1.254 1.322 0 C-N-CA 124.964 1.306 . . . . 0.0 114.496 176.837 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 19.0 mmt . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 118.363 -0.827 . . . . 0.0 110.79 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo -56.7 -47.77 21.97 Favored 'Trans proline' 0 CA--C 1.545 1.067 0 C-N-CA 123.602 2.868 . . . . 0.0 114.21 170.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -76.46 157.36 36.66 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 122.4 2.067 . . . . 0.0 112.105 170.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 15.3 t -164.66 152.76 12.13 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 125.203 1.401 . . . . 0.0 111.639 174.155 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.404 ' CE1' ' HB2' ' A' ' 123' ' ' CYS . 1.9 m-85 -125.0 136.61 53.89 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.405 1.482 . . . . 0.0 110.714 -169.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 88.7 p -140.96 157.24 67.72 Favored Pre-proline 0 CA--C 1.548 0.894 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 177.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -70.37 160.59 89.59 Favored 'Cis proline' 0 C--N 1.352 0.716 0 CA-C-N 119.0 0.679 . . . . 0.0 110.887 -11.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.46 -30.71 69.84 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 172.284 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 49.8 tp -140.32 120.68 14.0 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.569 1.548 . . . . 0.0 109.358 171.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 61.0 tp -102.83 127.02 50.17 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.45 1.5 . . . . 0.0 109.171 172.129 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.6 t -109.7 124.9 66.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 123.902 0.881 . . . . 0.0 108.811 171.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.2 m -127.17 169.91 17.88 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 124.639 1.176 . . . . 0.0 111.551 172.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 94.5 m -100.66 147.28 26.16 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.043 1.337 . . . . 0.0 110.058 173.101 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -59.27 126.6 28.33 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.178 0.991 . . . . 0.0 111.823 -174.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 91.65 -2.84 77.7 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 125.993 1.759 . . . . 0.0 114.473 -174.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 38.3 t0 -83.35 156.84 22.8 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.841 1.821 . . . . 0.0 112.004 173.267 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -79.21 123.75 27.7 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.567 0.747 . . . . 0.0 109.806 170.175 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -102.66 129.4 49.24 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 117.68 -1.152 . . . . 0.0 110.567 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 31.3 m -132.79 129.65 38.84 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 119.377 0.99 . . . . 0.0 112.222 -177.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -106.21 159.62 15.96 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 127.625 2.37 . . . . 0.0 110.731 169.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 85.9 m -109.76 134.72 51.7 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.5 1.52 . . . . 0.0 109.108 170.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 64.2 m -131.55 125.74 33.09 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.981 1.312 . . . . 0.0 110.237 172.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 91.2 p -104.29 148.17 26.67 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.099 0.96 . . . . 0.0 110.817 175.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -145.23 151.19 38.0 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 124.852 1.261 . . . . 0.0 112.347 178.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.0 t -153.79 143.1 21.49 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.727 0.811 . . . . 0.0 110.799 168.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 62.9 m-80 -135.92 162.85 31.68 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.878 1.671 . . . . 0.0 110.648 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 21.3 p -68.25 -26.26 65.6 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.108 1.363 . . . . 0.0 112.901 178.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 23.5 p -81.54 161.29 23.64 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.205 1.802 . . . . 0.0 112.194 169.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -70.45 -24.6 62.92 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.636 1.574 . . . . 0.0 113.044 -175.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.6 t -156.96 164.13 38.36 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.156 1.382 . . . . 0.0 111.684 -174.189 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 35.0 p90 -162.88 166.15 24.34 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.973 1.709 . . . . 0.0 111.318 -169.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 50.6 t -95.87 124.34 48.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 N-CA-C 107.559 -1.274 . . . . 0.0 107.559 170.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -99.33 141.76 31.68 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 126.655 1.982 . . . . 0.0 108.896 177.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -141.96 154.91 45.39 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.932 1.693 . . . . 0.0 111.258 -175.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 20.3 t90 -128.2 143.0 51.0 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.944 1.298 . . . . 0.0 111.395 175.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -138.13 148.3 44.79 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.818 1.247 . . . . 0.0 114.164 -170.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 53.5 ttt-85 -109.19 143.19 38.93 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.234 1.414 . . . . 0.0 109.65 168.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 85.7 mmm -75.38 135.07 40.82 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 118.333 0.515 . . . . 0.0 111.368 173.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.2 p -85.7 165.64 34.06 Favored Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 123.478 0.711 . . . . 0.0 112.429 172.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -58.62 -28.31 85.65 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 123.45 2.767 . . . . 0.0 113.498 170.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.7 m -83.52 0.96 44.24 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.874 1.27 . . . . 0.0 113.277 175.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 74.05 21.71 2.51 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 127.613 2.365 . . . . 0.0 113.429 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 18.7 mm100 -87.42 -178.96 6.28 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.71 0.804 . . . . 0.0 110.393 169.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.8 p -126.83 119.35 26.62 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.94 1.696 . . . . 0.0 109.388 -173.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -104.07 128.62 51.7 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.717 0.807 . . . . 0.0 111.199 -179.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -76.53 127.62 33.18 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.045 0.938 . . . . 0.0 112.065 -172.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 66.2 mt -106.75 -44.35 4.47 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 125.343 1.457 . . . . 0.0 112.406 -169.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -166.97 169.71 12.75 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.479 1.912 . . . . 0.0 110.432 -176.1 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.56 165.77 32.18 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.645 1.178 . . . . 0.0 112.76 -171.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 75.0 t80 -147.49 123.0 5.29 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 125.388 1.475 . . . . 0.0 110.533 170.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -55.65 144.73 19.24 Favored 'Cis proline' 0 C--N 1.351 0.665 0 CA-C-N 120.126 1.081 . . . . 0.0 111.94 -10.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -82.72 150.07 26.93 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-O 121.539 0.685 . . . . 0.0 112.567 -176.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -152.78 38.93 0.53 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.52 1.528 . . . . 0.0 110.731 -177.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.3 mmm180 -63.89 -6.97 6.83 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 115.97 1.841 . . . . 0.0 115.97 -168.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 36.4 p -68.77 -9.49 51.12 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.491 1.117 . . . . 0.0 113.713 169.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -61.26 163.65 10.35 Favored Pre-proline 0 CA--C 1.551 0.982 0 C-N-CA 124.393 1.077 . . . . 0.0 112.701 169.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.8 135.8 71.32 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 122.918 2.412 . . . . 0.0 110.638 168.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 89.26 36.03 7.77 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 123.502 0.572 . . . . 0.0 112.454 -169.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -69.88 126.12 28.75 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.184 1.394 . . . . 0.0 110.853 176.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -143.02 145.98 33.42 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.004 1.321 . . . . 0.0 111.744 174.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 51.9 m -109.7 -7.4 15.08 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 -179.273 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 48.5 mtp180 -84.61 -32.95 23.45 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.672 1.189 . . . . 0.0 112.567 179.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -88.63 142.38 27.74 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.368 1.067 . . . . 0.0 111.388 176.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 48.6 mtm180 -143.0 154.16 43.71 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.054 1.341 . . . . 0.0 112.79 -172.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 37.6 t -126.49 134.05 67.25 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 126.392 1.877 . . . . 0.0 108.702 168.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 95.3 m -123.91 126.06 45.71 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.262 1.425 . . . . 0.0 108.666 169.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 6.8 pm0 -83.62 141.56 31.45 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.322 1.049 . . . . 0.0 111.146 174.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 18.1 mt -87.81 156.25 52.72 Favored Pre-proline 0 CA--C 1.542 0.668 0 C-N-CA 123.685 0.794 . . . . 0.0 111.526 178.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -66.43 -4.61 11.05 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 123.361 2.708 . . . . 0.0 114.148 176.163 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -71.83 -10.5 59.87 Favored 'General case' 0 CA--C 1.551 1.015 0 CA-C-N 119.895 1.225 . . . . 0.0 113.281 171.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 92.15 -19.43 49.58 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 125.775 1.655 . . . . 0.0 116.024 169.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 11.9 ptp180 -154.63 73.65 0.91 Allowed 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 122.736 1.255 . . . . 0.0 110.842 173.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -167.43 144.77 4.53 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 128.7 2.8 . . . . 0.0 107.834 -176.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -146.66 147.52 31.11 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 113.82 1.044 . . . . 0.0 113.82 -168.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 51.6 m170 -109.0 127.93 54.51 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.827 1.651 . . . . 0.0 109.758 168.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.1 mpt? -113.52 126.74 55.65 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 126.253 1.821 . . . . 0.0 108.592 -176.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 93.7 p -142.67 149.06 38.38 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 116.841 2.163 . . . . 0.0 116.841 -171.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 11.1 t -103.41 122.44 55.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 126.849 2.059 . . . . 0.0 108.684 174.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 86.3 t -73.59 120.98 23.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 124.382 1.073 . . . . 0.0 109.675 169.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 49.3 72.61 0.29 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 126.006 1.722 . . . . 0.0 111.807 172.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.58 135.4 52.85 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.367 1.067 . . . . 0.0 111.954 -172.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -102.88 157.8 16.72 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 126.312 1.845 . . . . 0.0 109.937 175.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 74.9 mtm180 -52.47 -30.39 29.59 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 175.388 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 32.1 t30 -63.14 -24.74 68.03 Favored 'General case' 0 CA--C 1.551 1.009 0 N-CA-C 114.927 1.455 . . . . 0.0 114.927 173.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -74.82 -21.19 59.42 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 119.811 1.187 . . . . 0.0 112.87 -179.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 17.6 m -57.65 131.86 51.53 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.552 1.141 . . . . 0.0 113.198 -175.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 156.64 -165.92 33.17 Favored Glycine 0 CA--C 1.529 0.961 0 C-N-CA 124.523 1.059 . . . . 0.0 113.157 -172.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.4 m -93.25 143.01 26.68 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.058 1.343 . . . . 0.0 111.139 -175.284 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 61.9 m-85 -140.81 157.3 45.59 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.702 1.601 . . . . 0.0 111.515 -177.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.6 pp -154.98 156.24 35.65 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.285 1.034 . . . . 0.0 111.857 173.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . 0.404 ' HB2' ' CE1' ' A' ' 37' ' ' PHE . 79.6 m -101.77 162.38 12.95 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.002 0.921 . . . . 0.0 110.741 173.539 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -155.11 158.83 28.65 Favored Glycine 0 N--CA 1.47 0.929 0 O-C-N 121.473 -0.767 . . . . 0.0 112.98 173.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -146.98 156.7 43.26 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 117.952 0.876 . . . . 0.0 112.766 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.0 tt -146.98 134.39 14.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 124.829 1.252 . . . . 0.0 110.983 -175.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 48.2 t -61.84 158.18 16.52 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.045 0.938 . . . . 0.0 113.068 178.666 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 68.4 mt -72.95 -12.61 61.01 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.26 1.024 . . . . 0.0 112.949 176.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -67.43 143.95 97.56 Favored Pre-proline 0 CA--C 1.554 1.1 0 C-N-CA 124.451 1.1 . . . . 0.0 112.583 177.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_exo -57.33 -30.77 88.94 Favored 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 123.624 2.883 . . . . 0.0 114.846 177.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -87.93 7.23 31.89 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 124.687 1.195 . . . . 0.0 114.163 -176.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.78 165.99 14.06 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.928 1.291 . . . . 0.0 114.319 -175.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 31.2 tt0 -146.49 149.88 34.5 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.215 1.806 . . . . 0.0 109.116 178.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 56.1 mt -73.39 124.64 30.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 123.377 0.671 . . . . 0.0 111.112 -176.002 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -84.81 142.99 29.38 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.037 1.735 . . . . 0.0 110.904 172.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -142.79 158.89 43.18 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.978 1.711 . . . . 0.0 110.638 -175.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 5.5 t -144.12 -171.57 3.59 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.424 1.09 . . . . 0.0 111.947 175.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -63.25 125.23 23.42 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.182 1.393 . . . . 0.0 110.585 -176.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -65.56 163.77 15.48 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 -173.15 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.96 168.21 10.27 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.021 2.129 . . . . 0.0 111.317 175.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -131.52 142.95 50.06 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.883 1.273 . . . . 0.0 111.623 177.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 66.1 tp -109.87 133.81 52.75 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 125.954 1.701 . . . . 0.0 109.883 170.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 72.0 ttt180 -123.94 120.14 31.64 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.676 1.59 . . . . 0.0 108.986 169.055 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 44.4 t -104.19 120.34 54.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 170.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 67.2 p -98.22 148.75 23.28 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.234 1.814 . . . . 0.0 109.521 177.452 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -64.02 151.01 44.07 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.313 -0.867 . . . . 0.0 113.226 -172.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 48.3 ttt85 -73.36 125.0 26.84 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 123.953 0.901 . . . . 0.0 108.638 -173.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 33.7 ptt-85 -143.22 159.78 41.68 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.966 0.906 . . . . 0.0 113.153 -167.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -73.36 154.28 40.14 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.846 1.258 . . . . 0.0 112.589 175.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 . . . . . 0 C--O 1.255 1.365 0 C-N-CA 125.24 1.416 . . . . 0.0 113.359 175.83 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.408 0 CA-C-O 118.806 -0.616 . . . . 0.0 110.453 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.12 147.68 67.5 Favored 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 122.768 2.312 . . . . 0.0 109.878 172.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -68.11 119.16 6.17 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 123.8 3.0 . . . . 0.0 111.462 -169.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 6.0 t -166.63 171.12 11.96 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.296 1.438 . . . . 0.0 111.44 -174.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -160.28 157.86 28.82 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 125.943 1.697 . . . . 0.0 113.243 176.708 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 95.1 p -140.78 158.74 64.72 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 125.163 1.385 . . . . 0.0 112.568 174.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -73.48 160.88 95.18 Favored 'Cis proline' 0 C--N 1.351 0.686 0 CA-C-N 118.485 0.495 . . . . 0.0 111.311 -9.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.75 -30.58 71.59 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 171.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 45.9 tp -136.79 117.67 14.17 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.947 1.699 . . . . 0.0 109.046 171.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.2 tp -100.69 127.36 47.12 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.43 1.492 . . . . 0.0 109.439 174.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.0 t -109.99 124.2 66.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 123.979 0.911 . . . . 0.0 108.809 172.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.4 m -127.86 167.06 23.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 124.916 1.286 . . . . 0.0 111.595 172.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 67.1 m -93.4 148.49 22.02 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.485 1.114 . . . . 0.0 110.145 174.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -53.93 119.9 5.64 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.885 1.274 . . . . 0.0 111.708 177.359 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 94.59 -3.28 68.22 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 126.104 1.812 . . . . 0.0 114.886 -177.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -88.83 155.18 19.7 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 119.281 1.54 . . . . 0.0 111.582 174.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -80.82 134.61 35.81 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.292 -0.88 . . . . 0.0 111.437 173.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -107.22 131.75 53.83 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.13 1.772 . . . . 0.0 110.592 178.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 28.6 m -132.75 125.09 29.37 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.846 0.858 . . . . 0.0 111.302 -179.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -101.49 153.23 19.89 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.249 1.42 . . . . 0.0 110.357 169.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 66.9 m -117.05 117.67 30.27 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.213 1.005 . . . . 0.0 110.166 178.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 21.6 m -101.0 151.12 22.16 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.699 1.2 . . . . 0.0 113.157 169.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 70.3 m -127.05 115.42 19.17 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.01 1.324 . . . . 0.0 109.207 174.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -144.13 152.73 41.33 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 126.291 1.837 . . . . 0.0 110.083 -178.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 78.6 p -153.52 148.15 26.25 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.368 1.067 . . . . 0.0 111.463 169.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 55.3 m-80 -136.86 -174.05 3.61 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.417 1.487 . . . . 0.0 110.982 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 70.8 p -68.49 168.69 12.29 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.673 1.589 . . . . 0.0 112.794 -176.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.5 m -60.8 -9.4 4.01 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.712 1.605 . . . . 0.0 114.649 -179.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 38.4 mm-40 -67.22 -20.37 65.68 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 124.709 1.204 . . . . 0.0 112.643 170.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.6 t 84.76 166.84 0.09 Allowed 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 127.982 2.513 . . . . 0.0 113.126 176.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 24.4 p90 -154.27 159.31 41.22 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 -170.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 45.7 t -110.85 134.0 54.53 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 C-N-CA 127.076 2.15 . . . . 0.0 107.847 171.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 30.8 tp -109.17 134.14 52.11 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.324 0.65 . . . . 0.0 110.087 169.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -124.96 148.98 48.13 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.505 1.522 . . . . 0.0 111.241 -169.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 34.6 t-105 -110.22 138.83 46.07 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.4 1.48 . . . . 0.0 111.665 175.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -132.99 146.03 51.4 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.1 1.36 . . . . 0.0 112.441 -177.07 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 38.5 ttp180 -91.7 136.59 33.02 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.693 1.597 . . . . 0.0 107.541 167.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 16.6 ttm -111.44 133.14 53.95 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.972 1.309 . . . . 0.0 110.206 -179.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 51.0 m -85.62 160.61 53.07 Favored Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 125.301 1.44 . . . . 0.0 112.391 179.046 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_exo -58.56 -26.39 78.46 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 124.237 3.291 . . . . 0.0 114.136 174.36 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.9 p -76.95 1.32 18.06 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.891 1.677 . . . . 0.0 113.643 174.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 30.5 m-80 69.81 20.98 6.59 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 127.635 2.374 . . . . 0.0 112.786 -176.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -85.84 169.85 12.94 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.637 0.775 . . . . 0.0 110.364 169.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.7 p -138.92 152.48 47.77 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.967 1.307 . . . . 0.0 111.974 -173.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -136.9 131.11 32.66 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.362 1.865 . . . . 0.0 110.296 -178.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -85.05 129.27 34.83 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.16 0.984 . . . . 0.0 111.96 -173.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 55.5 mt -107.44 -57.1 2.13 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.282 1.033 . . . . 0.0 110.892 -172.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -162.18 173.84 13.73 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.526 1.13 . . . . 0.0 111.286 -173.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.62 172.17 18.28 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.104 1.361 . . . . 0.0 111.639 -177.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 45.6 t80 -138.46 118.36 9.79 Favored Pre-proline 0 CA--C 1.546 0.791 0 CA-C-O 118.507 -0.759 . . . . 0.0 110.521 168.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -59.14 144.98 32.5 Favored 'Cis proline' 0 C--N 1.353 0.768 0 CA-C-N 119.375 0.813 . . . . 0.0 111.153 -8.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -74.06 138.14 43.82 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -168.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -97.69 18.98 14.37 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.989 1.715 . . . . 0.0 112.526 -174.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 28.8 mmm180 -64.4 -48.42 75.46 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.587 1.155 . . . . 0.0 112.161 -176.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 42.8 m 59.78 19.01 7.83 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 125.75 1.62 . . . . 0.0 115.351 169.445 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -135.87 149.96 70.19 Favored Pre-proline 0 CA--C 1.543 0.71 0 C-N-CA 125.345 1.458 . . . . 0.0 112.052 -169.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -54.58 132.03 49.03 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 123.528 2.819 . . . . 0.0 111.48 170.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 82.6 -9.13 59.88 Favored Glycine 0 CA--C 1.534 1.258 0 CA-C-O 118.403 -1.22 . . . . 0.0 114.413 -176.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 56.84 -101.11 0.12 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 127.135 2.174 . . . . 0.0 112.171 171.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -142.98 145.13 32.68 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.383 1.873 . . . . 0.0 109.812 167.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.9 p -86.0 -17.22 35.89 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 115.26 1.578 . . . . 0.0 115.26 -177.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.3 ptm180 -153.63 -18.01 0.14 Allowed 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 116.72 2.119 . . . . 0.0 116.72 -169.523 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -103.63 117.23 33.93 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.831 1.252 . . . . 0.0 109.751 176.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 15.8 mmt180 -144.43 155.51 43.78 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.697 0.799 . . . . 0.0 112.277 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 31.1 t -126.56 140.39 49.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 C-N-CA 125.085 1.354 . . . . 0.0 110.582 176.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 96.3 m -130.63 134.28 46.84 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 125.474 1.509 . . . . 0.0 111.098 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -78.79 135.33 37.06 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.997 1.319 . . . . 0.0 109.967 169.519 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 21.5 mt -82.11 159.29 65.63 Favored Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 124.187 0.995 . . . . 0.0 112.386 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -64.2 -6.89 12.39 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 123.301 2.667 . . . . 0.0 114.287 174.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -73.85 -7.65 53.03 Favored 'General case' 0 CA--C 1.551 1.017 0 CA-C-N 120.022 1.283 . . . . 0.0 113.261 170.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 83.49 -14.07 43.03 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 125.518 1.532 . . . . 0.0 116.092 169.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.57 73.52 0.91 Allowed 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 123.103 1.43 . . . . 0.0 111.341 172.085 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -171.47 145.41 2.08 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 128.482 2.713 . . . . 0.0 108.186 -176.356 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -142.96 141.68 31.48 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -168.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 23.0 m170 -102.57 130.34 49.4 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.598 1.559 . . . . 0.0 110.806 169.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -114.77 111.54 21.4 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.974 1.71 . . . . 0.0 108.621 179.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 32.4 m -110.37 130.46 55.55 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.623 1.169 . . . . 0.0 112.935 -168.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 34.0 t -110.47 101.41 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 126.889 2.076 . . . . 0.0 107.112 168.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 70.9 t -74.32 133.87 30.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 123.785 0.834 . . . . 0.0 110.266 -178.361 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 39.1 ttm180 57.2 62.84 2.06 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.911 1.284 . . . . 0.0 110.737 172.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.41 135.38 47.22 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 124.475 1.11 . . . . 0.0 111.173 -175.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.98 167.31 10.49 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.29 1.436 . . . . 0.0 111.026 175.336 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 12.2 mtp180 -58.86 -23.02 60.26 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 113.915 1.079 . . . . 0.0 113.915 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -69.34 -21.98 63.79 Favored 'General case' 0 CA--C 1.553 1.07 0 N-CA-C 114.104 1.15 . . . . 0.0 114.104 170.501 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -77.23 -20.12 55.68 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 119.771 1.169 . . . . 0.0 113.565 174.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 49.1 m -57.29 129.22 40.8 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 119.86 1.209 . . . . 0.0 112.358 -178.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 154.55 -166.71 32.35 Favored Glycine 0 N--CA 1.471 0.991 0 C-N-CA 124.218 0.913 . . . . 0.0 113.421 -171.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.3 m -91.01 143.64 26.5 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.436 1.094 . . . . 0.0 110.998 -175.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -140.73 158.06 44.52 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.637 1.975 . . . . 0.0 110.619 176.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.4 pp -158.03 166.48 32.43 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 120.839 -1.163 . . . . 0.0 113.466 -178.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -114.19 135.89 53.55 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.226 1.81 . . . . 0.0 110.697 -174.585 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -138.99 130.37 4.83 Favored Glycine 0 N--CA 1.472 1.072 0 C-N-CA 123.997 0.808 . . . . 0.0 113.276 179.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -102.72 155.07 18.56 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.75 1.22 . . . . 0.0 112.725 -176.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 19.2 tt -155.93 144.52 12.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 125.339 1.455 . . . . 0.0 109.57 176.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 2.2 m -65.27 161.58 19.15 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 121.045 -1.035 . . . . 0.0 112.971 178.505 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 59.2 tp -60.58 -34.66 74.52 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.112 0.965 . . . . 0.0 112.154 169.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -66.83 127.88 93.64 Favored Pre-proline 0 CA--C 1.554 1.133 0 C-N-CA 124.481 1.112 . . . . 0.0 111.891 178.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -56.69 -24.59 55.59 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 124.108 3.205 . . . . 0.0 115.834 -178.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -70.6 -6.45 36.75 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 178.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.06 173.23 5.69 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.458 1.503 . . . . 0.0 114.103 -178.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -140.5 161.77 36.93 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.215 1.806 . . . . 0.0 109.668 174.481 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 28.4 mt -82.7 124.36 39.31 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 CA-C-O 121.174 0.511 . . . . 0.0 111.44 -169.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -91.41 127.31 36.8 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.342 1.857 . . . . 0.0 110.178 171.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -137.25 139.1 40.76 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.101 1.36 . . . . 0.0 111.041 -178.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 57.5 m -147.74 143.51 27.62 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.812 1.645 . . . . 0.0 110.063 171.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 42.6 mt 66.84 -178.55 0.21 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 126.978 2.111 . . . . 0.0 113.526 176.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.4 145.73 20.63 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.243 1.817 . . . . 0.0 110.572 169.656 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.86 165.09 13.48 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.829 1.652 . . . . 0.0 110.897 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -127.35 136.09 51.41 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 124.392 1.077 . . . . 0.0 110.23 -171.3 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 62.5 tp -110.36 131.89 54.66 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 125.554 1.541 . . . . 0.0 109.598 174.117 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 70.8 ttt180 -122.86 120.97 35.06 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.717 1.607 . . . . 0.0 109.566 170.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 28.7 t -104.41 118.22 51.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 C-N-CA 124.429 1.092 . . . . 0.0 109.026 170.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 71.9 p -98.5 155.71 17.13 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.738 1.615 . . . . 0.0 110.935 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -64.45 141.24 58.84 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 121.61 0.719 . . . . 0.0 112.347 -177.219 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 26.0 ttp-105 -80.62 123.48 28.18 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.133 1.373 . . . . 0.0 110.166 179.279 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 34.3 ttp180 -74.39 149.07 40.67 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.764 0.826 . . . . 0.0 111.749 -177.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -66.55 154.24 40.9 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 123.664 0.786 . . . . 0.0 110.572 167.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 . . . . . 0 C--O 1.252 1.221 0 C-N-CA 125.703 1.601 . . . . 0.0 114.196 -174.988 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 21.8 mmt . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 116.481 -1.724 . . . . 0.0 112.754 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -64.83 159.91 43.45 Favored 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 122.393 2.062 . . . . 0.0 111.533 174.172 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -75.6 101.95 1.54 Allowed 'Trans proline' 0 C--N 1.351 0.671 0 C-N-CA 124.069 3.179 . . . . 0.0 110.875 -174.425 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 91.8 m -124.32 148.22 47.61 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 125.015 1.326 . . . . 0.0 110.463 -171.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 50.6 t80 -145.47 118.88 9.0 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.225 1.81 . . . . 0.0 109.27 175.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 71.7 m -140.77 159.97 60.48 Favored Pre-proline 0 N--CA 1.477 0.886 0 C-N-CA 124.306 1.042 . . . . 0.0 113.352 -168.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -70.03 156.69 93.39 Favored 'Cis proline' 0 C--N 1.354 0.832 0 CA-C-N 119.723 0.937 . . . . 0.0 111.415 -4.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.03 -21.92 64.06 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 176.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 51.5 tp -143.68 121.68 12.09 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.311 1.444 . . . . 0.0 108.876 169.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 49.7 tp -111.12 126.96 55.39 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.536 1.534 . . . . 0.0 109.264 173.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 40.3 t -115.78 120.08 63.74 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 124.219 1.008 . . . . 0.0 108.927 176.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 26.9 m -123.64 166.97 18.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 125.57 1.548 . . . . 0.0 111.72 174.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 24.4 m -90.95 151.11 21.21 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.796 1.238 . . . . 0.0 110.701 174.227 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -51.73 124.87 13.42 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.246 1.418 . . . . 0.0 111.56 174.069 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.57 -1.36 88.9 Favored Glycine 0 CA--C 1.533 1.213 0 C-N-CA 125.487 1.517 . . . . 0.0 114.849 -177.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -88.67 162.13 16.47 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 119.421 1.61 . . . . 0.0 111.808 175.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -89.89 136.44 33.04 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.192 0.997 . . . . 0.0 110.65 176.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -116.79 135.95 53.35 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.255 1.422 . . . . 0.0 110.95 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 22.4 m -132.72 124.26 27.83 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 118.945 0.793 . . . . 0.0 111.869 178.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -100.79 159.56 15.09 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.648 1.579 . . . . 0.0 110.239 169.009 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 35.9 m -116.22 131.36 56.96 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.154 1.381 . . . . 0.0 110.38 177.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 50.3 t -117.96 143.26 46.52 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.457 1.903 . . . . 0.0 112.533 176.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 68.7 m -142.82 131.12 22.11 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.602 1.161 . . . . 0.0 111.417 177.158 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 -139.87 156.13 46.86 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 126.641 1.977 . . . . 0.0 113.126 177.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.2 t -103.68 134.32 47.22 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.925 1.29 . . . . 0.0 109.438 166.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -147.77 177.11 9.58 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.188 1.795 . . . . 0.0 110.802 -177.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 87.3 m -59.84 135.71 57.78 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.466 1.107 . . . . 0.0 110.18 173.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 44.1 p -72.71 -17.34 61.63 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 114.611 1.337 . . . . 0.0 114.611 -170.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -70.49 -46.0 64.59 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.003 0.921 . . . . 0.0 112.104 179.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 13.0 t -178.14 159.81 1.32 Allowed 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 126.864 2.066 . . . . 0.0 111.243 175.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 51.0 p90 -162.92 157.75 21.54 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.281 1.832 . . . . 0.0 110.855 179.308 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 46.0 t -107.87 136.07 44.46 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 124.887 1.275 . . . . 0.0 108.715 174.202 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -123.25 123.6 41.13 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.313 1.445 . . . . 0.0 108.776 -177.204 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 9.9 m-80 -123.48 152.51 41.63 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.559 1.543 . . . . 0.0 113.153 -167.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 12.6 t90 -117.51 135.71 53.74 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.836 1.654 . . . . 0.0 111.645 175.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -130.69 147.98 52.42 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.239 1.416 . . . . 0.0 113.481 -178.333 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 40.3 ttp180 -100.29 137.26 38.96 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 126.543 1.937 . . . . 0.0 107.331 167.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 16.0 ttm -112.02 134.84 53.33 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.321 1.448 . . . . 0.0 110.423 -175.362 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.1 m -91.4 157.5 42.24 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 124.82 1.248 . . . . 0.0 112.143 178.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -56.46 -31.48 85.99 Favored 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 124.209 3.273 . . . . 0.0 114.009 176.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.4 m -76.93 9.77 2.71 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.209 1.404 . . . . 0.0 113.624 177.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 64.2 t30 69.69 26.29 4.97 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 127.104 2.162 . . . . 0.0 112.908 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -94.45 168.36 10.92 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.245 1.018 . . . . 0.0 110.479 172.076 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.0 p -138.81 152.49 47.92 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.069 1.348 . . . . 0.0 111.536 -178.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -133.62 129.93 37.6 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 126.584 1.954 . . . . 0.0 110.105 -178.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -82.95 129.05 34.98 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.863 0.865 . . . . 0.0 111.389 -175.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 55.3 mt -104.21 -50.02 3.45 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.173 0.989 . . . . 0.0 111.963 -171.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -170.25 169.52 7.69 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.611 1.964 . . . . 0.0 109.675 -175.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.59 153.27 22.81 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.872 1.269 . . . . 0.0 110.926 -176.074 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -105.48 135.61 19.34 Favored Pre-proline 0 CA--C 1.547 0.846 0 C-N-CA 123.972 0.909 . . . . 0.0 110.994 174.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -68.29 148.23 82.51 Favored 'Cis proline' 0 C--N 1.352 0.727 0 CA-C-N 119.395 0.819 . . . . 0.0 111.102 -6.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -78.4 94.64 4.92 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.845 0.831 . . . . 0.0 111.857 -172.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 53.7 t0 -103.84 97.0 7.07 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.626 1.57 . . . . 0.0 108.314 168.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 15.7 mmt85 -76.71 4.16 10.14 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -175.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 60.3 p -81.13 -14.29 57.84 Favored 'General case' 0 CA--C 1.547 0.846 0 O-C-N 121.266 -0.896 . . . . 0.0 112.144 167.628 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 60.3 mm-40 -85.2 167.3 26.53 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 125.178 1.391 . . . . 0.0 111.244 175.545 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -61.71 -0.37 1.5 Allowed 'Trans proline' 0 C--N 1.354 0.836 0 C-N-CA 124.529 3.486 . . . . 0.0 116.802 176.382 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -90.12 61.22 3.34 Favored Glycine 0 C--N 1.338 0.645 0 C-N-CA 125.418 1.485 . . . . 0.0 109.441 171.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 5.1 tp60 -135.61 114.02 11.61 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.12 0.968 . . . . 0.0 111.313 -175.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -142.98 150.18 39.32 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.251 1.821 . . . . 0.0 110.073 168.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 75.3 m -70.29 -24.33 63.01 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 114.446 1.276 . . . . 0.0 114.446 -177.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.4 ptp180 -102.66 -21.11 14.18 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 114.71 1.374 . . . . 0.0 114.71 -171.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -103.18 147.98 26.34 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.209 1.404 . . . . 0.0 111.968 -172.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -143.24 151.98 41.19 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.852 1.661 . . . . 0.0 111.989 172.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 46.2 t -121.32 128.56 75.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 124.414 1.085 . . . . 0.0 110.139 169.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 91.5 m -122.96 132.4 54.14 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.137 1.375 . . . . 0.0 110.312 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 24.8 tt0 -86.78 139.08 31.06 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.978 0.911 . . . . 0.0 110.722 173.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 28.7 mt -92.46 158.29 38.86 Favored Pre-proline 0 CA--C 1.546 0.794 0 C-N-CA 124.897 1.279 . . . . 0.0 111.808 177.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -67.72 -1.81 7.42 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 123.648 2.899 . . . . 0.0 114.235 175.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 25.3 m120 -64.81 -16.78 63.54 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 172.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 105.44 -34.0 6.11 Favored Glycine 0 N--CA 1.474 1.216 0 C-N-CA 126.127 1.822 . . . . 0.0 114.293 170.009 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 35.0 ptt180 -154.58 73.59 0.91 Allowed 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 123.098 1.428 . . . . 0.0 110.813 169.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -151.83 137.69 18.05 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 127.761 2.425 . . . . 0.0 106.958 179.32 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 -139.81 139.52 36.39 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -167.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -103.55 130.68 51.0 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.836 1.254 . . . . 0.0 111.71 170.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -107.04 105.4 15.4 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 127.276 2.23 . . . . 0.0 108.966 179.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 30.2 t -107.6 123.92 49.19 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.727 0.811 . . . . 0.0 112.705 -170.23 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 12.1 t -95.25 119.86 43.88 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 126.355 1.862 . . . . 0.0 106.928 169.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 81.3 t -91.43 128.54 43.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 123.558 0.743 . . . . 0.0 109.876 175.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 69.9 ttt180 53.46 60.55 3.63 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.911 1.684 . . . . 0.0 111.604 174.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.06 134.67 52.32 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.735 0.814 . . . . 0.0 111.362 -172.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.22 167.28 10.68 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.615 1.566 . . . . 0.0 110.261 -179.439 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 88.4 mtm-85 -56.88 -27.75 60.94 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 120.96 -1.088 . . . . 0.0 113.205 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -56.43 -27.77 57.58 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 126.673 1.989 . . . . 0.0 114.527 169.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 -86.95 -14.47 41.7 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 -175.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 52.7 m -59.36 129.88 44.19 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.793 1.179 . . . . 0.0 112.066 175.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 164.46 -159.7 32.67 Favored Glycine 0 N--CA 1.472 1.09 0 O-C-N 121.792 -0.567 . . . . 0.0 113.727 -176.2 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 8.5 m -100.65 144.42 29.65 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.107 1.363 . . . . 0.0 109.983 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 -143.62 155.43 44.26 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.653 1.581 . . . . 0.0 111.551 -178.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.3 pp -157.12 164.91 37.35 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.891 1.276 . . . . 0.0 112.525 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 21.2 t -113.78 155.51 25.52 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.282 1.433 . . . . 0.0 111.052 -179.382 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -154.67 144.23 10.89 Favored Glycine 0 N--CA 1.471 0.995 0 O-C-N 121.304 -0.873 . . . . 0.0 114.297 177.076 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -132.2 158.2 42.35 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -173.562 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 17.0 tt -152.34 134.97 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 125.316 1.446 . . . . 0.0 111.17 178.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 60.9 m -72.9 161.64 30.46 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.108 1.363 . . . . 0.0 113.417 177.324 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -59.73 -21.56 60.85 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 116.122 1.897 . . . . 0.0 116.122 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -72.92 147.73 88.84 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 124.399 1.08 . . . . 0.0 112.653 -173.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -67.22 -20.2 49.67 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.085 2.523 . . . . 0.0 112.75 176.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 82.7 tttt -75.82 -13.07 60.28 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 124.801 1.241 . . . . 0.0 113.558 174.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.11 161.64 26.45 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.533 1.133 . . . . 0.0 113.033 -177.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -147.98 152.76 38.04 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.914 1.686 . . . . 0.0 108.631 175.148 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 36.2 mt -71.69 115.39 11.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 O-C-N 121.695 -0.628 . . . . 0.0 110.63 -176.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 48.1 tttp -90.63 141.8 28.41 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.829 1.252 . . . . 0.0 109.661 169.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -110.87 151.01 28.35 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.69 1.196 . . . . 0.0 111.96 -175.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 59.8 p -86.4 176.95 7.6 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.815 1.246 . . . . 0.0 113.275 174.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 99.1 mt -68.65 139.95 55.47 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 166.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.63 148.97 33.02 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 -178.33 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -123.76 169.64 11.32 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 127.182 2.193 . . . . 0.0 111.243 177.266 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -119.74 141.7 49.2 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.981 1.312 . . . . 0.0 112.37 179.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 52.2 tp -109.69 137.8 46.98 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 125.817 1.647 . . . . 0.0 109.752 169.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -128.84 125.01 36.81 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.604 1.562 . . . . 0.0 110.31 173.078 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 40.6 t -108.13 112.44 40.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 C-N-CA 125.224 1.409 . . . . 0.0 108.597 169.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 64.6 p -91.59 154.93 18.72 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.573 1.549 . . . . 0.0 110.241 177.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -58.88 151.0 22.63 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.754 0.822 . . . . 0.0 112.693 -175.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 22.9 tpt180 -61.0 119.28 7.99 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.895 1.278 . . . . 0.0 109.893 -176.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -71.9 141.7 49.52 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 122.953 0.501 . . . . 0.0 111.805 -169.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -69.96 154.32 42.1 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.584 1.154 . . . . 0.0 112.906 177.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 . . . . . 0 C--O 1.253 1.241 0 C-N-CA 127.213 2.205 . . . . 0.0 113.394 177.261 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.552 0 CA-C-O 116.277 -1.821 . . . . 0.0 112.389 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -68.93 156.52 65.1 Favored 'Trans proline' 0 CA--C 1.544 0.989 0 C-N-CA 122.461 2.108 . . . . 0.0 110.96 174.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -64.58 114.73 2.84 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 124.05 3.166 . . . . 0.0 111.832 -173.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.0 t -156.76 154.44 29.98 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.881 1.672 . . . . 0.0 111.568 -178.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -134.34 125.66 28.08 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.964 1.706 . . . . 0.0 109.704 -173.073 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 91.0 p -140.87 157.49 67.34 Favored Pre-proline 0 CA--C 1.549 0.909 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 -169.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -68.32 162.17 80.04 Favored 'Cis proline' 0 C--N 1.355 0.92 0 CA-C-N 119.474 0.848 . . . . 0.0 111.862 -4.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.82 -26.52 68.17 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 176.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 48.0 tp -141.81 123.28 14.95 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.493 1.517 . . . . 0.0 108.889 170.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 53.7 tp -108.79 125.1 51.58 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.3 1.44 . . . . 0.0 109.34 172.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.2 t -110.4 121.39 63.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 124.165 0.986 . . . . 0.0 108.967 175.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.5 m -125.46 172.15 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 C-N-CA 125.009 1.323 . . . . 0.0 111.972 173.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 9.5 m -96.94 151.86 19.28 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 125.789 1.636 . . . . 0.0 110.612 176.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -45.71 122.81 3.9 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.536 1.134 . . . . 0.0 112.525 169.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.57 3.21 88.53 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 125.502 1.525 . . . . 0.0 114.508 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 31.2 t0 -90.4 159.12 16.75 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 119.393 1.597 . . . . 0.0 112.375 177.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 70.2 m-20 -88.96 117.57 28.07 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.345 1.058 . . . . 0.0 110.369 176.506 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -99.19 130.07 45.47 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.856 1.262 . . . . 0.0 110.547 178.22 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 60.9 m -131.92 127.2 35.93 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 119.347 0.976 . . . . 0.0 111.41 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -101.3 158.44 16.05 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.135 1.774 . . . . 0.0 110.474 172.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 37.5 m -106.69 131.23 54.06 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.322 1.449 . . . . 0.0 109.28 173.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 48.5 t -111.69 129.74 56.01 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.902 1.281 . . . . 0.0 110.893 169.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 8.4 t -122.46 131.22 53.76 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.537 1.135 . . . . 0.0 108.666 173.078 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 41.3 p90 -160.73 156.28 25.12 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.442 1.097 . . . . 0.0 112.291 -176.188 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 31.6 m -131.84 115.19 15.61 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.556 1.142 . . . . 0.0 109.013 169.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -84.74 178.01 7.81 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 -173.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 23.6 m -58.2 -61.5 2.51 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 126.203 1.801 . . . . 0.0 113.18 -169.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 75.3 p -176.63 166.56 2.65 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.961 1.304 . . . . 0.0 112.791 -173.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 71.4 -67.07 0.27 Allowed 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 128.429 2.691 . . . . 0.0 113.69 169.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 32.9 t 176.3 160.49 0.33 Allowed 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 129.229 3.011 . . . . 0.0 108.222 -170.234 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 28.5 p90 -150.74 162.44 40.71 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 114.718 1.377 . . . . 0.0 114.718 -169.154 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 64.5 t -105.88 129.48 58.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 126.529 1.932 . . . . 0.0 107.017 167.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 51.3 tp -99.32 143.21 29.84 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.94 1.296 . . . . 0.0 109.453 173.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -138.62 154.56 48.67 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.507 1.523 . . . . 0.0 111.032 -176.706 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 14.9 t90 -128.74 135.66 49.51 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.019 1.328 . . . . 0.0 110.744 175.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 57.8 m-85 -129.06 148.9 51.05 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.95 1.3 . . . . 0.0 113.596 -174.001 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 55.3 ttt-85 -109.03 142.99 38.92 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.694 1.598 . . . . 0.0 108.257 167.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 30.1 mtp -85.77 145.88 27.04 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 118.948 0.794 . . . . 0.0 112.509 176.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 69.1 m -94.07 157.66 37.42 Favored Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 125.494 1.518 . . . . 0.0 111.37 173.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -66.71 -16.72 51.2 Favored 'Trans proline' 0 CA--C 1.54 0.825 0 C-N-CA 123.256 2.637 . . . . 0.0 113.383 176.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 40.7 p -76.98 -1.15 27.26 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.118 1.767 . . . . 0.0 113.783 169.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 70.15 20.98 6.15 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 127.849 2.46 . . . . 0.0 113.08 -172.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -88.53 -172.68 3.85 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.423 1.089 . . . . 0.0 110.175 168.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.0 p -142.76 151.49 41.29 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.83 1.652 . . . . 0.0 110.728 -176.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -128.96 133.41 47.8 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 124.645 1.178 . . . . 0.0 111.616 174.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -78.15 129.22 34.9 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.43 1.092 . . . . 0.0 111.472 -179.158 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 57.9 mt -105.57 -47.75 3.84 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 125.575 1.55 . . . . 0.0 112.345 -169.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -162.04 170.02 19.99 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 127.072 2.149 . . . . 0.0 109.68 -174.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.55 171.52 19.5 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.41 1.084 . . . . 0.0 112.042 -172.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -146.79 111.45 4.17 Favored Pre-proline 0 CA--C 1.546 0.799 0 C-N-CA 125.026 1.33 . . . . 0.0 109.462 171.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -64.85 155.83 75.8 Favored 'Cis proline' 0 CA--C 1.54 0.794 0 CA-C-N 119.641 0.908 . . . . 0.0 111.721 -5.468 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -76.37 130.73 38.49 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.391 0.677 . . . . 0.0 112.701 -178.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 35.0 m-20 -90.94 1.77 56.77 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.108 1.363 . . . . 0.0 112.593 169.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 57.4 mtm180 -76.03 14.21 0.74 Allowed 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 127.022 2.129 . . . . 0.0 115.722 -168.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 29.4 m -69.73 -24.08 63.49 Favored 'General case' 0 CA--C 1.545 0.755 0 O-C-N 121.215 -0.928 . . . . 0.0 111.796 168.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -77.61 152.56 80.83 Favored Pre-proline 0 CA--C 1.548 0.872 0 C-N-CA 125.078 1.351 . . . . 0.0 110.894 169.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -69.93 156.23 63.42 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 123.145 2.563 . . . . 0.0 112.345 -179.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 108.42 14.13 17.11 Favored Glycine 0 CA--C 1.535 1.285 0 C-N-CA 125.004 1.287 . . . . 0.0 114.449 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -82.56 170.86 14.72 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.247 1.419 . . . . 0.0 112.412 174.18 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -142.83 139.43 30.9 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.912 1.285 . . . . 0.0 111.414 175.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 16.4 m -66.75 -19.0 65.66 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 115.268 1.581 . . . . 0.0 115.268 -169.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 82.0 mtt85 -60.77 -44.95 96.1 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -91.34 131.56 36.76 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 -164.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 21.4 ttm-85 -144.49 143.99 31.13 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.497 1.119 . . . . 0.0 112.352 169.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 91.8 t -107.3 131.31 57.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 126.638 1.975 . . . . 0.0 109.035 173.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 90.0 m -130.58 133.27 46.05 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.32 1.448 . . . . 0.0 110.686 -178.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -79.08 141.79 37.04 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.165 0.986 . . . . 0.0 112.318 178.095 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 26.6 mt -92.88 162.4 28.95 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 123.543 0.737 . . . . 0.0 111.628 171.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -58.04 -21.03 48.32 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 123.924 3.083 . . . . 0.0 114.093 172.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 41.1 t30 -64.99 -13.83 58.77 Favored 'General case' 0 CA--C 1.552 1.02 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 -179.325 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 83.08 -34.01 2.86 Favored Glycine 0 N--CA 1.475 1.281 0 C-N-CA 125.882 1.706 . . . . 0.0 114.649 171.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 23.0 ptt180 -130.17 73.5 1.54 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 125.391 1.476 . . . . 0.0 109.523 169.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -178.78 140.68 0.18 Allowed 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 127.569 2.348 . . . . 0.0 109.338 -177.364 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -147.3 153.64 39.97 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.316 1.046 . . . . 0.0 112.79 -168.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -106.91 139.51 41.21 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.609 1.564 . . . . 0.0 111.464 169.167 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.4 mpt? -120.1 106.11 11.66 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 126.471 1.908 . . . . 0.0 109.05 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 77.8 p -108.75 128.26 54.72 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.872 0.869 . . . . 0.0 113.333 -172.042 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 32.5 t -100.14 99.07 7.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 127.859 2.463 . . . . 0.0 106.846 169.107 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 29.2 m -74.46 139.77 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 O-C-N 121.749 -0.595 . . . . 0.0 111.861 178.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 32.2 ttm180 53.84 49.51 18.96 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.81 1.644 . . . . 0.0 112.626 170.265 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.5 148.56 50.4 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.195 0.998 . . . . 0.0 112.778 -171.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -124.32 164.73 19.0 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.836 1.254 . . . . 0.0 111.856 178.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 86.5 mtm-85 -52.58 -37.21 57.58 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.401 1.081 . . . . 0.0 113.557 -172.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -48.43 -34.31 10.77 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.859 2.064 . . . . 0.0 114.599 171.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -81.51 -13.91 57.57 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.504 1.122 . . . . 0.0 112.738 -168.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.8 m -59.92 131.1 49.82 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.307 1.043 . . . . 0.0 112.474 179.127 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 161.46 -166.83 36.08 Favored Glycine 0 N--CA 1.473 1.134 0 C-N-CA 124.418 1.008 . . . . 0.0 113.622 -171.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 7.6 m -96.62 140.0 31.88 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.28 1.032 . . . . 0.0 110.816 -175.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 64.8 m-85 -136.44 156.73 48.21 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.004 1.722 . . . . 0.0 111.704 179.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -156.59 150.89 25.34 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 176.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 52.1 t -95.04 151.62 19.03 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 126.486 1.914 . . . . 0.0 111.437 177.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -164.1 138.07 5.09 Favored Glycine 0 N--CA 1.472 1.069 0 O-C-N 121.424 -0.797 . . . . 0.0 114.538 172.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -121.27 159.2 26.48 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.474 1.11 . . . . 0.0 112.644 -178.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 21.2 tt -147.57 135.9 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 125.586 1.554 . . . . 0.0 111.249 -176.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 36.8 t -72.25 161.17 31.23 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.044 0.937 . . . . 0.0 113.46 -178.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 65.7 mt -82.83 -11.45 58.23 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.735 1.214 . . . . 0.0 112.693 169.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -68.73 157.23 89.17 Favored Pre-proline 0 CA--C 1.551 1.018 0 C-N-CA 125.067 1.347 . . . . 0.0 112.358 176.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -66.97 -21.82 49.18 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 122.968 2.445 . . . . 0.0 113.192 178.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.52 6.28 15.3 Favored 'General case' 0 CA--C 1.551 0.994 0 N-CA-C 114.817 1.414 . . . . 0.0 114.817 177.149 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -62.62 159.22 16.44 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.755 1.391 . . . . 0.0 114.755 -171.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -157.23 149.13 22.5 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 127.091 2.156 . . . . 0.0 108.29 -176.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 11.7 mm -71.44 107.6 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 171.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -82.31 88.42 6.54 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.954 0.902 . . . . 0.0 109.308 173.249 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -69.97 134.68 48.61 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.116 0.966 . . . . 0.0 111.37 -178.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 68.7 m -84.74 155.95 21.65 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.155 0.982 . . . . 0.0 112.338 171.457 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -59.82 128.26 36.02 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 121.694 -0.629 . . . . 0.0 109.426 169.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -69.67 157.99 36.21 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 114.371 1.249 . . . . 0.0 114.371 -170.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -127.77 164.41 22.21 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.791 2.037 . . . . 0.0 111.639 176.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -116.24 140.35 49.41 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.767 1.227 . . . . 0.0 111.542 177.354 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 62.1 tp -106.97 134.63 49.83 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.983 1.713 . . . . 0.0 109.563 169.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 59.7 ttt85 -126.92 122.67 35.25 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 125.652 1.581 . . . . 0.0 109.786 170.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 36.4 t -107.46 115.99 49.99 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 C-N-CA 124.866 1.266 . . . . 0.0 108.626 171.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 23.6 p -87.92 161.72 17.3 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.858 1.263 . . . . 0.0 110.925 -179.506 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -58.13 153.01 15.65 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 122.879 0.471 . . . . 0.0 110.376 168.295 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 17.2 mtt180 -67.22 106.83 2.14 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 123.448 0.699 . . . . 0.0 110.011 176.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.77 152.47 39.03 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.267 1.027 . . . . 0.0 111.989 -173.755 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -72.05 154.39 41.16 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.522 1.129 . . . . 0.0 112.586 175.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 . . . . . 0 N--CA 1.485 1.285 0 C-N-CA 127.228 2.211 . . . . 0.0 113.383 177.105 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 56.8 mtt . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 116.572 -1.68 . . . . 0.0 112.494 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -69.87 164.2 35.52 Favored 'Trans proline' 0 C--N 1.357 1.02 0 C-N-CA 122.808 2.339 . . . . 0.0 112.2 -179.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -59.46 143.71 99.62 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 123.578 2.852 . . . . 0.0 115.667 -174.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 15.2 t -143.08 160.15 40.92 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 126.468 1.907 . . . . 0.0 110.197 169.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -148.38 121.78 9.06 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.019 1.328 . . . . 0.0 111.075 -169.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 89.8 p -140.94 160.23 59.1 Favored Pre-proline 0 CA--C 1.55 0.981 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -172.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -68.49 162.55 79.94 Favored 'Cis proline' 0 C--N 1.354 0.825 0 CA-C-N 119.883 0.994 . . . . 0.0 111.482 -7.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.6 -30.74 71.57 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 174.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 33.1 tp -135.46 123.37 22.63 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.739 1.615 . . . . 0.0 109.061 171.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 57.6 tp -107.49 126.6 52.72 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.587 1.155 . . . . 0.0 109.358 169.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.4 t -110.2 124.32 66.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 124.011 0.924 . . . . 0.0 108.916 173.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.6 m -128.24 167.29 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 124.904 1.282 . . . . 0.0 111.938 173.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 51.4 m -93.62 148.92 21.66 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.571 1.148 . . . . 0.0 110.466 175.274 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -53.97 119.33 4.89 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.414 1.486 . . . . 0.0 112.103 178.227 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.04 -0.43 78.9 Favored Glycine 0 CA--C 1.532 1.124 0 C-N-CA 126.21 1.862 . . . . 0.0 115.057 -178.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 40.6 t0 -86.15 158.73 19.7 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 119.11 1.455 . . . . 0.0 111.223 171.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 12.1 p30 -80.85 150.84 28.96 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-O 121.911 0.862 . . . . 0.0 111.453 169.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -133.38 122.59 23.99 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.125 1.77 . . . . 0.0 110.576 -173.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 28.0 m -129.38 126.86 39.82 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 118.832 0.742 . . . . 0.0 111.854 -176.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -101.95 157.07 17.13 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.212 1.805 . . . . 0.0 109.817 169.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 31.6 m -106.35 123.78 48.58 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.944 1.298 . . . . 0.0 109.553 175.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 44.8 t -107.08 134.76 49.73 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.657 1.183 . . . . 0.0 109.735 168.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 9.2 m -133.72 128.82 35.72 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.7 0.8 . . . . 0.0 110.222 -174.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -158.93 153.56 24.48 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.373 1.069 . . . . 0.0 111.595 173.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 63.7 m -83.4 101.57 11.45 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.409 0.623 . . . . 0.0 112.109 -176.24 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 19.7 m120 -69.6 130.54 42.71 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.224 1.009 . . . . 0.0 111.481 178.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 70.5 p -104.78 -169.54 1.63 Allowed 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.747 1.619 . . . . 0.0 111.036 -178.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 36.5 p -73.08 -6.54 46.32 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.9 1.28 . . . . 0.0 113.827 170.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -82.45 110.18 17.34 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.702 1.201 . . . . 0.0 109.478 174.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 15.1 m -59.81 138.62 57.74 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.65 1.58 . . . . 0.0 112.285 -178.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 32.9 p90 -149.33 168.29 23.75 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 115.154 1.538 . . . . 0.0 115.154 -167.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 58.2 t -124.33 135.29 64.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 127.49 2.316 . . . . 0.0 106.981 167.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 29.3 tp -99.39 138.7 36.11 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.509 0.724 . . . . 0.0 109.924 172.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 7.2 m-80 -130.93 159.19 38.17 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.818 1.247 . . . . 0.0 111.483 -172.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 9.0 t90 -125.84 138.21 53.8 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.312 1.045 . . . . 0.0 111.979 177.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -131.15 144.7 51.57 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.777 1.231 . . . . 0.0 112.796 -176.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -106.78 142.61 36.14 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.45 1.5 . . . . 0.0 108.54 168.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 26.1 mtp -83.29 143.91 30.07 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.95 0.795 . . . . 0.0 112.461 175.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 69.0 m -105.69 148.55 36.63 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 125.47 1.508 . . . . 0.0 111.081 176.028 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -68.05 -16.04 44.24 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 123.977 3.118 . . . . 0.0 114.024 -173.236 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 17.5 m -76.91 8.61 3.59 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.812 1.245 . . . . 0.0 113.206 171.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 57.6 t30 71.31 46.07 0.45 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 127.805 2.442 . . . . 0.0 111.466 -177.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -131.38 -172.66 2.9 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.669 1.588 . . . . 0.0 110.27 -178.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.7 p -144.47 149.18 35.56 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.964 1.706 . . . . 0.0 110.526 -176.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -125.28 134.65 52.2 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.106 1.362 . . . . 0.0 111.314 176.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -78.84 133.0 37.04 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.988 0.915 . . . . 0.0 111.517 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 53.5 mt -107.65 -46.77 3.75 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.767 1.227 . . . . 0.0 112.714 -169.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -169.79 169.42 8.42 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.73 2.012 . . . . 0.0 110.482 -172.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -157.25 162.01 39.22 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.861 1.265 . . . . 0.0 113.163 -179.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -139.92 122.5 10.12 Favored Pre-proline 0 CA--C 1.547 0.839 0 C-N-CA 126.326 1.851 . . . . 0.0 110.1 174.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_exo -53.92 157.27 14.96 Favored 'Cis proline' 0 C--N 1.351 0.661 0 CA-C-N 120.56 1.236 . . . . 0.0 113.719 -7.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -62.79 115.08 4.03 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.182 0.993 . . . . 0.0 113.533 -169.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -85.12 7.55 21.29 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 125.521 1.528 . . . . 0.0 111.957 169.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.3 tpm_? -53.05 -38.01 62.09 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 127.912 2.485 . . . . 0.0 113.05 178.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.5 t 75.01 -54.65 0.66 Allowed 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 127.578 2.351 . . . . 0.0 113.283 175.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -135.79 148.7 66.36 Favored Pre-proline 0 CA--C 1.546 0.813 0 C-N-CA 124.873 1.269 . . . . 0.0 112.19 -175.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -82.18 174.21 10.2 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 124.436 3.424 . . . . 0.0 111.349 174.105 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 88.8 9.36 68.48 Favored Glycine 0 CA--C 1.531 1.033 0 C-N-CA 124.108 0.861 . . . . 0.0 112.983 -179.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -151.89 138.54 18.76 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.335 1.854 . . . . 0.0 109.25 -178.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 15.5 t0 -142.95 137.0 29.1 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.301 1.44 . . . . 0.0 111.007 -179.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 84.3 p -94.23 -9.1 37.31 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.801 1.24 . . . . 0.0 113.69 176.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 41.3 mtm180 77.77 -27.05 0.17 Allowed 'General case' 0 C--N 1.346 0.436 0 C-N-CA 131.184 3.793 . . . . 0.0 113.845 -176.59 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -67.22 142.11 57.06 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.548 1.539 . . . . 0.0 110.968 168.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 85.0 mtm180 -143.85 148.75 35.94 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.997 1.719 . . . . 0.0 111.281 -174.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 40.2 t -126.49 126.33 68.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 125.451 1.5 . . . . 0.0 108.452 171.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 87.9 m -130.61 130.52 44.1 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.075 0.95 . . . . 0.0 110.996 178.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 65.4 tt0 -82.85 135.08 35.05 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 118.658 0.663 . . . . 0.0 110.042 169.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 37.1 mt -91.85 158.94 39.13 Favored Pre-proline 0 CA--C 1.543 0.681 0 C-N-CA 124.112 0.965 . . . . 0.0 112.205 -172.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -63.92 -6.88 11.9 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 123.64 2.893 . . . . 0.0 114.02 174.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -63.32 -26.15 68.63 Favored 'General case' 0 CA--C 1.55 0.974 0 CA-C-N 119.462 1.028 . . . . 0.0 112.155 168.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 91.19 -34.08 4.44 Favored Glycine 0 CA--C 1.531 1.037 0 C-N-CA 126.717 2.103 . . . . 0.0 113.938 175.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -126.84 73.44 1.41 Allowed 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.917 1.287 . . . . 0.0 109.48 171.376 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -178.37 146.0 0.36 Allowed 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 126.396 1.878 . . . . 0.0 110.742 -177.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -145.83 139.8 26.62 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.031 0.933 . . . . 0.0 111.773 -170.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -98.91 131.03 45.3 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.403 1.081 . . . . 0.0 111.85 169.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 20.8 mmt -108.98 103.24 12.23 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.983 2.113 . . . . 0.0 107.726 174.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 22.8 t -121.46 125.55 47.16 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 114.9 1.444 . . . . 0.0 114.9 -167.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 3.7 t -92.35 123.24 44.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 125.244 1.417 . . . . 0.0 108.229 168.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 87.6 t -82.89 128.4 38.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 168.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 44.3 ttt85 56.78 69.67 0.72 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.787 1.235 . . . . 0.0 112.07 171.03 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -74.35 134.48 42.5 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.409 1.083 . . . . 0.0 111.508 -177.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -108.63 163.03 13.6 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.032 1.733 . . . . 0.0 109.666 174.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 64.6 mtp85 -56.83 -28.01 60.94 Favored 'General case' 0 N--CA 1.478 0.947 0 O-C-N 121.021 -1.049 . . . . 0.0 113.74 179.116 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -61.46 -16.72 49.79 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.306 1.443 . . . . 0.0 114.623 171.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -89.68 -12.84 38.35 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.218 1.407 . . . . 0.0 113.634 178.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 48.1 m -64.74 138.16 58.22 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 120.815 -1.178 . . . . 0.0 112.132 -178.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 149.2 -165.8 29.43 Favored Glycine 0 N--CA 1.474 1.192 0 C-N-CA 124.13 0.871 . . . . 0.0 113.592 -176.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.5 m -91.23 142.66 27.48 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.165 1.386 . . . . 0.0 111.284 -174.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -138.78 160.82 38.76 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.678 1.991 . . . . 0.0 111.745 -178.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -156.29 147.12 21.96 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.603 1.161 . . . . 0.0 113.355 173.517 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 51.4 t -84.16 150.44 25.51 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.341 1.857 . . . . 0.0 110.704 173.156 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -161.43 129.52 2.13 Favored Glycine 0 N--CA 1.474 1.172 0 O-C-N 121.184 -0.947 . . . . 0.0 114.4 174.209 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -90.66 159.26 16.49 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.151 0.981 . . . . 0.0 112.197 178.638 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 17.2 tt -146.39 138.67 19.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 124.702 1.201 . . . . 0.0 109.781 170.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 7.3 m -81.11 161.48 24.1 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.763 0.825 . . . . 0.0 112.384 179.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 55.9 mt -78.6 -12.51 60.02 Favored 'General case' 0 N--CA 1.476 0.875 0 N-CA-C 114.115 1.154 . . . . 0.0 114.115 178.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -67.03 148.19 98.93 Favored Pre-proline 0 CA--C 1.553 1.064 0 C-N-CA 124.12 0.968 . . . . 0.0 112.532 179.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -55.96 -28.79 70.46 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 123.598 2.865 . . . . 0.0 114.601 176.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -85.14 4.42 34.45 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.747 1.219 . . . . 0.0 114.227 -179.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -63.09 159.17 17.88 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.99 1.108 . . . . 0.0 113.99 -176.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -150.63 166.54 30.02 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.73 2.012 . . . . 0.0 109.005 174.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 51.0 mt -73.11 114.16 12.05 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-O 121.584 0.707 . . . . 0.0 109.918 -178.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -81.47 88.37 6.16 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.991 1.716 . . . . 0.0 107.917 169.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -75.4 141.73 43.18 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.136 0.975 . . . . 0.0 112.354 -171.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 6.9 t -91.35 178.64 5.91 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.803 1.241 . . . . 0.0 111.848 169.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.6 pp -76.35 159.05 30.88 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.868 0.867 . . . . 0.0 112.061 174.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 91.0 mtm180 -83.58 150.54 25.87 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.251 1.02 . . . . 0.0 113.038 -174.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -136.93 169.62 17.47 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 127.164 2.186 . . . . 0.0 109.693 169.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -132.57 147.57 52.35 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 177.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 63.6 tp -107.41 134.46 50.42 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 126.982 2.113 . . . . 0.0 109.954 177.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 69.5 ttt180 -122.62 121.55 36.7 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 125.938 1.695 . . . . 0.0 109.885 171.393 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 44.2 t -103.39 117.6 49.09 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.704 1.202 . . . . 0.0 108.848 170.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 74.4 p -96.54 150.97 20.03 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.578 1.551 . . . . 0.0 110.24 177.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -64.03 142.74 58.3 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.328 0.585 . . . . 0.0 111.851 -178.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 54.1 ttp180 -78.14 116.81 18.87 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.782 0.833 . . . . 0.0 110.147 179.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 6.5 ppt_? -72.86 163.6 27.89 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.17 0.988 . . . . 0.0 112.771 -178.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -68.03 150.4 48.49 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.35 1.06 . . . . 0.0 112.592 177.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 . . . . . 0 C--O 1.253 1.259 0 N-CA-C 114.925 1.454 . . . . 0.0 114.925 -177.205 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.487 0 CA-C-O 118.611 -0.709 . . . . 0.0 111.586 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -57.35 153.38 40.86 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 123.888 3.059 . . . . 0.0 113.337 178.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -73.24 118.02 5.35 Favored 'Trans proline' 0 N--CA 1.459 -0.538 0 C-N-CA 123.759 2.973 . . . . 0.0 110.531 176.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 66.6 p -129.0 157.47 41.61 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.264 1.026 . . . . 0.0 112.043 -176.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -144.14 124.66 13.98 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.043 1.737 . . . . 0.0 108.869 178.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 78.9 p -140.82 161.15 55.67 Favored Pre-proline 0 CA--C 1.55 0.95 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 -168.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -66.43 163.54 69.51 Favored 'Cis proline' 0 C--N 1.355 0.881 0 CA-C-N 119.572 0.883 . . . . 0.0 111.664 -7.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.78 -33.12 71.28 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 174.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.6 tt -136.34 124.32 22.82 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.61 1.564 . . . . 0.0 109.139 171.02 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.4 tp -106.75 130.3 54.49 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.75 1.22 . . . . 0.0 108.948 169.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 12.8 p -113.0 129.92 67.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 C-N-CA 124.007 0.923 . . . . 0.0 109.692 169.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.6 m -131.81 164.76 33.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 125.065 1.346 . . . . 0.0 111.348 174.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 16.8 m -89.87 149.02 22.83 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.553 1.141 . . . . 0.0 110.303 172.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -53.88 121.7 8.5 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.047 1.339 . . . . 0.0 111.015 175.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.24 4.12 78.01 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 125.486 1.517 . . . . 0.0 114.894 -176.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -95.71 150.21 20.63 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 119.577 1.688 . . . . 0.0 111.159 169.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -75.41 130.77 39.5 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.267 -0.896 . . . . 0.0 111.543 175.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -101.71 122.08 43.25 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 125.47 1.508 . . . . 0.0 110.174 175.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 60.5 m -128.16 124.35 36.62 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.023 0.929 . . . . 0.0 110.827 -178.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -102.45 159.54 15.34 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 127.21 2.204 . . . . 0.0 110.524 175.265 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 30.7 m -113.21 127.55 56.21 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.956 1.302 . . . . 0.0 110.006 177.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 53.1 t -111.66 142.02 44.51 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.785 1.634 . . . . 0.0 111.854 173.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.5 t -138.89 119.32 13.8 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.717 0.807 . . . . 0.0 111.309 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -132.06 156.16 46.79 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 126.235 1.814 . . . . 0.0 113.103 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 86.1 p -138.78 158.04 44.95 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.449 1.9 . . . . 0.0 107.701 166.139 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -147.06 152.02 37.86 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 121.188 -0.945 . . . . 0.0 113.474 -168.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 21.0 p -80.18 -26.66 39.15 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.73 1.612 . . . . 0.0 112.902 178.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 49.5 m -84.27 152.61 24.06 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.487 1.115 . . . . 0.0 111.1 170.269 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -70.17 -11.34 60.83 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.316 1.846 . . . . 0.0 114.653 -176.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 25.8 m -161.37 152.54 18.58 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 126.251 1.821 . . . . 0.0 110.993 176.406 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 55.2 p90 -160.73 159.22 29.88 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.847 1.259 . . . . 0.0 112.396 -173.063 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 90.7 t -95.97 134.77 32.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 125.672 1.589 . . . . 0.0 107.467 169.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.4 tp -99.33 145.84 26.9 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.705 1.202 . . . . 0.0 109.472 170.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -134.92 156.76 48.41 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.844 1.657 . . . . 0.0 111.984 -169.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 22.6 t90 -136.24 138.84 42.24 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.553 1.141 . . . . 0.0 112.103 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 48.6 m-85 -138.9 149.09 44.43 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.818 1.247 . . . . 0.0 114.009 -172.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -109.13 143.36 38.61 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.779 1.631 . . . . 0.0 108.531 167.566 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 31.7 mtp -84.58 143.92 28.98 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 119.437 1.017 . . . . 0.0 112.612 173.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 45.6 m -91.48 158.02 41.31 Favored Pre-proline 0 CA--C 1.548 0.901 0 C-N-CA 124.954 1.302 . . . . 0.0 111.601 173.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_exo -55.5 -32.39 82.3 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 123.983 3.122 . . . . 0.0 114.495 178.373 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.0 m -76.94 5.93 7.11 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 124.892 1.277 . . . . 0.0 113.845 177.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 73.99 20.94 2.71 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 127.828 2.451 . . . . 0.0 113.041 -176.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -89.4 -172.61 3.68 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.585 1.154 . . . . 0.0 110.287 169.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.1 p -144.06 146.96 33.18 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 125.597 1.559 . . . . 0.0 110.521 -176.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -121.96 132.42 54.53 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 125.077 1.351 . . . . 0.0 110.848 175.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 33.3 tttm -80.57 117.18 21.05 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.194 1.398 . . . . 0.0 110.9 -177.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 71.7 mt -90.07 -52.72 4.81 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 125.187 1.395 . . . . 0.0 111.253 -172.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -160.74 173.51 15.3 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.84 1.256 . . . . 0.0 111.79 -178.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -156.06 156.4 34.31 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.437 1.495 . . . . 0.0 111.798 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -142.0 129.46 11.5 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 125.004 1.322 . . . . 0.0 110.73 178.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.17 155.84 19.97 Favored 'Cis proline' 0 C--N 1.353 0.766 0 CA-C-N 120.498 1.214 . . . . 0.0 112.825 -8.315 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -58.9 115.26 3.0 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 114.006 1.113 . . . . 0.0 114.006 -168.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -85.93 -0.26 54.97 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.315 1.446 . . . . 0.0 111.777 168.188 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 45.6 ttt85 -66.09 -77.68 0.06 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 127.936 2.494 . . . . 0.0 111.233 -179.081 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 10.9 t 67.44 -59.72 0.4 Allowed 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 127.207 2.203 . . . . 0.0 112.009 -172.079 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -117.99 155.53 51.09 Favored Pre-proline 0 CA--C 1.547 0.84 0 C-N-CA 127.071 2.148 . . . . 0.0 108.166 168.546 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -57.76 116.13 3.01 Favored 'Trans proline' 0 C--N 1.351 0.69 0 C-N-CA 122.874 2.383 . . . . 0.0 113.996 -171.119 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -106.32 -3.55 38.2 Favored Glycine 0 CA--C 1.535 1.293 0 C-N-CA 125.372 1.463 . . . . 0.0 113.037 171.021 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -159.62 159.19 32.85 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 128.106 2.562 . . . . 0.0 109.752 -174.758 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -73.59 159.78 32.61 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.818 0.847 . . . . 0.0 112.032 175.455 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 83.6 p -67.34 -5.8 15.97 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 114.393 1.257 . . . . 0.0 114.393 -177.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 48.1 mtp180 -68.78 -30.53 69.14 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.333 1.453 . . . . 0.0 113.002 173.283 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -97.7 119.71 36.77 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.221 1.409 . . . . 0.0 110.398 -174.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -139.48 145.67 39.06 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.416 1.086 . . . . 0.0 112.044 -169.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -126.56 135.95 62.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 125.153 1.381 . . . . 0.0 112.052 170.616 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 91.8 m -130.5 130.17 43.84 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.446 1.498 . . . . 0.0 110.756 -177.081 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -79.37 134.32 36.58 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.318 1.047 . . . . 0.0 110.371 173.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 36.4 mt -88.27 159.65 47.18 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 123.657 0.783 . . . . 0.0 111.829 178.199 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -63.4 -7.46 12.38 Favored 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 123.563 2.842 . . . . 0.0 113.979 173.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -67.23 -14.5 62.97 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 119.174 0.897 . . . . 0.0 112.946 169.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 83.98 -34.08 3.04 Favored Glycine 0 N--CA 1.473 1.123 0 C-N-CA 126.92 2.2 . . . . 0.0 114.343 172.092 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.67 73.59 1.46 Allowed 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 123.733 1.73 . . . . 0.0 109.669 173.349 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -174.89 141.72 0.62 Allowed 'General case' 0 C--O 1.237 0.418 0 C-N-CA 128.51 2.724 . . . . 0.0 108.095 -176.413 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -145.04 149.92 35.96 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.853 1.057 . . . . 0.0 113.853 -167.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -104.06 132.77 49.97 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.805 1.242 . . . . 0.0 110.479 167.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -112.87 123.31 50.02 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 126.652 1.981 . . . . 0.0 108.211 174.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 9.4 t -130.44 133.75 46.58 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 114.257 1.206 . . . . 0.0 114.257 -169.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 61.7 t -105.35 101.92 13.07 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 126.651 1.98 . . . . 0.0 106.817 168.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 98.0 t -73.2 125.53 32.3 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 123.66 0.784 . . . . 0.0 110.649 -177.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 72.3 mtt-85 51.08 70.42 0.53 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.597 1.959 . . . . 0.0 112.034 -177.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -66.34 134.09 51.86 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.79 1.636 . . . . 0.0 111.476 -178.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 8.3 mpt_? -108.38 166.68 10.58 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 126.11 1.764 . . . . 0.0 109.289 172.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 35.2 mtp180 -57.22 -30.2 64.39 Favored 'General case' 0 N--CA 1.478 0.962 0 O-C-N 121.033 -1.042 . . . . 0.0 113.619 -174.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -61.68 -19.39 62.29 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.464 1.506 . . . . 0.0 114.756 173.222 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 37.4 m-20 -84.59 -12.83 53.28 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 119.966 1.257 . . . . 0.0 113.481 177.223 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 48.4 m -63.1 143.85 57.42 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.734 1.152 . . . . 0.0 112.597 -179.466 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 143.42 -166.83 26.72 Favored Glycine 0 N--CA 1.474 1.173 0 O-C-N 121.262 -0.898 . . . . 0.0 113.469 -176.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.9 m -91.71 143.59 26.39 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 125.173 1.389 . . . . 0.0 111.08 -172.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -142.19 161.2 38.6 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.09 1.756 . . . . 0.0 111.57 -177.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -161.68 165.12 28.66 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.926 1.29 . . . . 0.0 113.054 177.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 13.6 t -108.79 156.65 19.38 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.974 1.709 . . . . 0.0 111.038 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -144.66 174.6 24.76 Favored Glycine 0 N--CA 1.47 0.959 0 C-N-CA 124.791 1.186 . . . . 0.0 113.436 176.274 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -152.45 159.24 43.39 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.184 0.994 . . . . 0.0 112.934 175.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 18.1 tt -152.22 135.01 6.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 125.463 1.505 . . . . 0.0 110.286 174.511 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 58.1 p -72.48 161.51 30.7 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.249 -0.907 . . . . 0.0 113.146 178.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 48.2 mt -75.58 -2.15 27.81 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 -179.029 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -68.07 150.83 97.6 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 124.611 1.164 . . . . 0.0 112.521 177.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_endo -69.51 -23.59 31.75 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.016 2.477 . . . . 0.0 112.787 176.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -91.38 8.1 37.83 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 125.088 1.355 . . . . 0.0 113.717 178.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.14 161.71 18.52 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.743 1.217 . . . . 0.0 113.922 -175.124 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -149.48 151.83 34.6 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.783 1.633 . . . . 0.0 109.251 178.233 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 51.2 mt -76.1 127.78 37.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 123.594 0.758 . . . . 0.0 111.957 -173.174 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -99.35 151.03 21.53 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.126 1.77 . . . . 0.0 109.328 168.097 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -132.54 149.12 52.37 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.27 1.028 . . . . 0.0 111.969 -172.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 60.6 p -87.6 177.85 6.94 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.858 1.263 . . . . 0.0 113.725 175.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -68.38 152.25 45.7 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.636 0.774 . . . . 0.0 109.208 166.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -82.12 152.84 26.36 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.113 0.965 . . . . 0.0 113.332 -177.405 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -124.67 169.66 11.75 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 127.158 2.183 . . . . 0.0 109.932 169.038 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -135.97 151.51 50.01 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 170.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 60.4 tp -112.87 132.91 55.1 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 126.704 2.002 . . . . 0.0 110.543 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 69.9 ttt180 -118.06 118.06 30.89 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.477 1.911 . . . . 0.0 109.663 171.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 42.4 t -102.3 116.67 46.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 123.82 0.848 . . . . 0.0 109.012 169.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 73.7 p -95.96 154.2 17.36 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.967 1.707 . . . . 0.0 110.606 178.251 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -64.61 145.61 55.91 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.641 -0.662 . . . . 0.0 112.32 -178.06 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 38.9 ttt85 -82.71 128.63 34.54 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.476 1.111 . . . . 0.0 110.361 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 36.2 ttp180 -72.16 147.87 46.18 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.532 0.733 . . . . 0.0 111.792 -177.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -67.85 154.35 41.75 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 123.99 0.916 . . . . 0.0 111.091 167.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 . . . . . 0 N--CA 1.485 1.296 0 C-N-CA 127.531 2.332 . . . . 0.0 113.242 179.35 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 97.3 mmm . . . . . 0 N--CA 1.49 1.534 0 CA-C-O 118.927 -0.559 . . . . 0.0 110.663 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -69.92 140.43 42.03 Favored 'Trans proline' 0 CA--C 1.543 0.944 0 C-N-CA 122.54 2.16 . . . . 0.0 110.917 178.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -73.26 155.94 51.21 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 123.44 2.76 . . . . 0.0 111.138 174.583 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.8 t -170.16 150.69 3.74 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.771 1.228 . . . . 0.0 111.758 -178.048 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.535 ' CE1' ' HB3' ' A' ' 123' ' ' CYS . 1.0 OUTLIER -125.99 136.52 53.08 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 125.522 1.529 . . . . 0.0 109.674 178.164 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 88.9 p -141.02 156.2 68.44 Favored Pre-proline 0 N--CA 1.478 0.935 0 N-CA-C 114.793 1.405 . . . . 0.0 114.793 -178.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -69.52 161.55 85.24 Favored 'Cis proline' 0 C--N 1.352 0.747 0 CA-C-N 119.307 0.788 . . . . 0.0 111.194 -10.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.47 -34.09 73.52 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 172.418 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 31.9 tp -132.83 121.14 22.51 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.757 1.623 . . . . 0.0 109.04 171.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 51.5 tp -105.09 130.38 53.29 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.63 1.172 . . . . 0.0 109.475 170.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.1 t -112.92 124.97 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 123.864 0.865 . . . . 0.0 109.104 173.087 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.3 m -127.22 166.36 24.1 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 C-N-CA 125.03 1.332 . . . . 0.0 111.828 173.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 45.4 m -91.47 147.16 23.22 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.337 1.055 . . . . 0.0 110.211 173.384 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 65.1 tt0 -53.96 116.44 2.56 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.79 1.636 . . . . 0.0 112.245 177.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 94.23 3.61 63.28 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 126.365 1.936 . . . . 0.0 114.825 -177.25 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 37.2 t0 -91.2 159.51 16.02 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 119.581 1.69 . . . . 0.0 111.622 172.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -85.32 130.58 34.56 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.224 -0.923 . . . . 0.0 111.373 172.263 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -103.01 133.83 47.47 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.923 1.689 . . . . 0.0 110.745 178.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 27.8 m -132.74 127.98 35.88 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.446 1.099 . . . . 0.0 111.906 178.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -105.36 159.56 15.81 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.222 2.209 . . . . 0.0 110.465 169.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 29.7 m -101.13 140.58 35.23 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.606 1.563 . . . . 0.0 109.182 169.56 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 17.4 t -131.53 131.94 43.78 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.697 1.599 . . . . 0.0 111.594 171.586 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 9.9 m -122.97 132.71 54.27 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.38 1.072 . . . . 0.0 111.109 179.271 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -137.76 156.13 48.3 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 126.168 1.787 . . . . 0.0 113.157 169.455 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 92.7 p -151.11 152.81 33.91 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.684 1.593 . . . . 0.0 109.231 167.345 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 69.8 m-80 -149.06 161.88 41.07 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.738 1.215 . . . . 0.0 112.1 -169.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 17.2 p -66.78 -43.24 84.49 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.375 1.47 . . . . 0.0 111.12 172.571 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 67.7 m -68.81 128.15 35.65 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.957 1.303 . . . . 0.0 110.059 169.036 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -72.13 -4.64 30.26 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.02 1.328 . . . . 0.0 114.281 -172.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 63.4 p -149.41 147.02 27.77 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.168 1.387 . . . . 0.0 112.072 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 38.1 p90 -166.01 159.67 15.81 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.354 1.462 . . . . 0.0 111.809 -171.002 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 30.4 t -95.97 138.27 21.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 125.387 1.475 . . . . 0.0 107.594 170.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 9.0 tt -127.78 131.26 49.64 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.373 1.469 . . . . 0.0 109.583 -177.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -145.66 160.91 41.0 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 115.323 1.601 . . . . 0.0 115.323 -167.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 61.1 t-105 -113.94 148.84 36.16 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 126.585 1.954 . . . . 0.0 112.253 -179.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -141.14 146.63 37.27 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.528 1.531 . . . . 0.0 113.89 -172.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 34.3 ttp-105 -91.21 140.21 30.01 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.887 1.675 . . . . 0.0 108.152 167.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 21.1 mtp -86.6 136.75 32.93 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 119.328 0.967 . . . . 0.0 111.021 168.274 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 68.8 m -106.32 148.67 37.11 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 125.143 1.377 . . . . 0.0 110.986 177.187 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -68.45 -17.6 43.81 Favored 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 124.085 3.19 . . . . 0.0 113.711 -171.065 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.4 m -76.97 21.31 0.22 Allowed 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 125.278 1.431 . . . . 0.0 112.927 170.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 64.5 t30 64.35 39.99 6.79 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.685 2.394 . . . . 0.0 112.455 177.447 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -133.05 179.24 6.3 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.139 1.376 . . . . 0.0 111.001 -172.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.8 p -137.03 152.51 50.19 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 125.528 1.531 . . . . 0.0 111.043 -177.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -133.33 131.56 40.27 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.747 1.219 . . . . 0.0 110.88 178.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 5.4 ttpm? -78.91 132.43 36.75 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.553 0.741 . . . . 0.0 111.876 -173.355 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 83.9 mt -110.49 -46.82 3.35 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 125.038 1.335 . . . . 0.0 112.205 -171.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -152.84 160.02 43.07 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.39 1.076 . . . . 0.0 111.573 -179.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -154.07 149.05 26.74 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.513 1.125 . . . . 0.0 112.977 -172.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -136.02 126.8 16.79 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 125.916 1.686 . . . . 0.0 109.908 169.456 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -54.69 162.88 12.17 Favored 'Cis proline' 0 C--N 1.351 0.709 0 CA-C-N 120.275 1.134 . . . . 0.0 113.278 -10.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -63.96 113.93 3.79 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.754 0.821 . . . . 0.0 112.335 -170.075 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -161.17 41.43 0.15 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.391 1.877 . . . . 0.0 110.589 -173.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -65.07 -38.19 89.99 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 114.165 1.172 . . . . 0.0 114.165 -169.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 7.9 m 78.75 -3.89 2.19 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 127.648 2.379 . . . . 0.0 114.271 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.5 pp0? -76.56 162.76 69.56 Favored Pre-proline 0 CA--C 1.551 1.009 0 C-N-CA 124.636 1.174 . . . . 0.0 111.56 173.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -62.1 -4.29 4.88 Favored 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 124.424 3.416 . . . . 0.0 118.544 -170.03 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 89.9 0.69 77.71 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 125.793 1.663 . . . . 0.0 111.649 -170.014 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 19.9 mm100 -88.46 -28.92 20.54 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.464 1.106 . . . . 0.0 113.619 -174.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -82.92 129.22 34.99 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -179.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 8.0 t -118.1 7.83 12.28 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 124.845 1.258 . . . . 0.0 112.716 171.174 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 47.8 mtp180 -84.07 -42.0 16.58 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.421 1.089 . . . . 0.0 112.658 -171.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -95.98 133.63 39.97 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.222 1.009 . . . . 0.0 111.083 -176.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 66.2 mtm180 -143.33 152.24 41.41 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.174 0.99 . . . . 0.0 113.105 -171.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.8 t -121.61 130.61 74.45 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 126.483 1.913 . . . . 0.0 108.562 169.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 94.6 m -129.44 135.41 48.63 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 125.17 1.388 . . . . 0.0 110.444 -175.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -76.31 141.75 41.5 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.217 1.007 . . . . 0.0 111.519 178.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 96.4 mt -101.48 157.05 34.4 Favored Pre-proline 0 CA--C 1.542 0.661 0 C-N-CA 124.16 0.984 . . . . 0.0 111.582 170.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -70.39 -2.8 11.21 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 123.537 2.825 . . . . 0.0 113.527 173.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -72.46 -6.0 40.63 Favored 'General case' 0 CA--C 1.551 1.019 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -179.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 95.55 -31.92 6.72 Favored Glycine 0 CA--C 1.534 1.266 0 C-N-CA 126.019 1.771 . . . . 0.0 115.27 169.47 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 32.6 ptt180 -154.6 73.76 0.91 Allowed 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.546 1.538 . . . . 0.0 109.905 172.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -167.36 145.47 4.77 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 126.287 1.835 . . . . 0.0 108.925 -169.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -144.42 150.11 37.15 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -168.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -101.1 138.0 38.71 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.239 1.416 . . . . 0.0 110.111 167.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 6.9 mmt -123.51 117.84 26.02 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 126.545 1.938 . . . . 0.0 108.3 -176.002 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 71.0 p -131.27 148.7 52.72 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 115.602 1.704 . . . . 0.0 115.602 -169.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 22.1 t -118.66 102.76 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 C-N-CA 127.478 2.311 . . . . 0.0 107.233 176.55 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 58.6 t -78.02 131.86 33.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 124.006 0.923 . . . . 0.0 110.147 -178.015 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 3.7 tpt180 63.07 53.93 2.22 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.423 1.489 . . . . 0.0 111.198 175.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.43 123.61 22.75 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.573 1.149 . . . . 0.0 111.062 -174.392 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? -106.73 169.76 8.34 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 126.085 1.754 . . . . 0.0 110.295 177.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 22.2 mmm180 -49.19 -37.35 22.33 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.61 1.164 . . . . 0.0 113.84 -175.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -60.07 -25.09 65.1 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 125.271 1.429 . . . . 0.0 114.697 175.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 -81.8 -1.87 48.88 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.896 1.278 . . . . 0.0 113.272 178.44 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 33.1 m -70.32 124.04 23.18 Favored 'General case' 0 CA--C 1.543 0.699 0 O-C-N 120.18 -1.575 . . . . 0.0 111.238 173.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 165.96 -171.48 41.08 Favored Glycine 0 N--CA 1.474 1.173 0 O-C-N 121.682 -0.636 . . . . 0.0 114.306 -177.068 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.0 m -88.9 139.72 30.17 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.725 1.21 . . . . 0.0 110.714 -179.254 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -144.2 157.67 44.16 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.046 1.738 . . . . 0.0 111.007 -177.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.5 pp -155.16 165.36 36.93 Favored 'General case' 0 N--CA 1.469 0.478 0 O-C-N 121.25 -0.906 . . . . 0.0 113.243 -178.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . 0.535 ' HB3' ' CE1' ' A' ' 37' ' ' PHE . 48.4 t -111.16 156.12 21.88 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.243 1.417 . . . . 0.0 110.574 175.064 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -144.51 167.95 26.89 Favored Glycine 0 CA--C 1.524 0.653 0 C-N-CA 124.496 1.046 . . . . 0.0 112.536 171.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -145.13 149.34 34.83 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.869 0.868 . . . . 0.0 111.844 175.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.4 tt -148.9 133.08 8.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 125.452 1.501 . . . . 0.0 110.842 -176.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 14.5 m -66.39 159.58 26.61 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.397 1.079 . . . . 0.0 112.656 179.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 29.4 mt -73.28 -14.38 61.3 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.213 1.19 . . . . 0.0 114.213 -174.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -72.35 143.03 85.09 Favored Pre-proline 0 CA--C 1.552 1.054 0 C-N-CA 124.294 1.037 . . . . 0.0 112.329 177.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -56.22 -27.01 64.07 Favored 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 123.829 3.019 . . . . 0.0 115.153 177.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -78.81 -4.34 48.96 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 -178.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.97 169.49 13.18 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 124.891 1.276 . . . . 0.0 113.766 -176.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -149.76 162.48 40.18 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.157 1.783 . . . . 0.0 110.21 175.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 10.0 mm -73.08 123.44 27.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-O 121.756 0.789 . . . . 0.0 111.757 -178.217 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -84.67 143.29 29.31 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 126.799 2.04 . . . . 0.0 110.171 169.636 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -134.14 158.85 42.6 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.594 1.558 . . . . 0.0 112.188 -172.12 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 5.9 t -140.21 -163.88 1.6 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.784 1.234 . . . . 0.0 111.664 169.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -65.89 114.34 5.04 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.545 1.538 . . . . 0.0 110.424 -178.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 1.4 ptp180 -71.43 154.74 41.31 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 125.372 1.469 . . . . 0.0 112.939 -177.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.89 169.63 9.09 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.633 1.973 . . . . 0.0 111.225 -171.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -136.51 146.84 46.69 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 122.228 1.013 . . . . 0.0 112.956 175.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 58.4 tp -109.69 134.29 52.14 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 127.1 2.16 . . . . 0.0 109.531 179.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 70.6 ttt180 -121.12 123.91 43.46 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 125.937 1.695 . . . . 0.0 109.574 171.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 53.9 t -103.07 120.44 52.93 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 C-N-CA 124.497 1.119 . . . . 0.0 108.132 169.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 54.7 p -93.29 147.53 22.83 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.289 1.436 . . . . 0.0 109.411 174.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -59.86 148.07 36.1 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.444 0.698 . . . . 0.0 112.244 -174.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 60.1 ttp180 -58.27 114.37 2.38 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 125.016 1.326 . . . . 0.0 110.199 -170.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 46.6 mtm105 -75.3 153.82 37.71 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.685 -168.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -70.54 154.38 41.94 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.545 1.138 . . . . 0.0 112.424 175.112 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 . . . . . 0 C--O 1.254 1.314 0 C-N-CA 125.27 1.428 . . . . 0.0 112.992 177.16 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 56.6 ttm . . . . . 0 N--CA 1.489 1.518 0 CA-C-O 118.191 -0.909 . . . . 0.0 110.343 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -60.0 166.74 8.27 Favored 'Trans proline' 0 CA--C 1.544 1.006 0 C-N-CA 123.98 3.12 . . . . 0.0 113.199 172.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -56.8 148.75 64.33 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 123.463 2.775 . . . . 0.0 113.313 174.593 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.2 t -171.76 147.72 2.29 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.496 1.518 . . . . 0.0 111.395 -178.563 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -122.52 135.36 54.63 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.166 1.386 . . . . 0.0 110.776 -172.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 94.2 p -141.01 157.14 67.84 Favored Pre-proline 0 CA--C 1.55 0.98 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -179.007 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -69.84 162.58 84.05 Favored 'Cis proline' 0 C--N 1.353 0.809 0 CA-C-N 118.919 0.65 . . . . 0.0 111.279 -9.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.33 -34.1 71.94 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 171.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 53.2 tp -140.16 122.91 16.4 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.433 1.493 . . . . 0.0 109.41 172.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.9 tp -105.16 127.23 52.81 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.76 1.624 . . . . 0.0 109.186 171.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.8 t -111.05 124.5 67.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 123.912 0.885 . . . . 0.0 108.879 172.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.1 m -129.38 168.14 23.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 C-N-CA 124.935 1.294 . . . . 0.0 111.567 172.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 23.4 m -92.33 151.67 20.17 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.165 1.386 . . . . 0.0 110.44 173.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -52.13 123.89 11.68 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.436 1.094 . . . . 0.0 110.7 169.026 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 89.5 -2.92 83.43 Favored Glycine 0 CA--C 1.533 1.16 0 C-N-CA 125.616 1.579 . . . . 0.0 114.762 -177.614 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -91.31 158.39 16.58 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 119.393 1.597 . . . . 0.0 112.012 175.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -87.65 123.59 32.65 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.171 0.988 . . . . 0.0 110.901 178.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -101.59 129.96 47.81 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.955 1.302 . . . . 0.0 110.534 177.072 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 27.1 m -131.7 128.02 38.09 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.407 1.083 . . . . 0.0 111.021 177.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -102.8 154.5 19.12 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 126.628 1.971 . . . . 0.0 110.505 169.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 65.4 m -107.37 134.15 50.85 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.172 1.389 . . . . 0.0 109.001 170.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 73.2 m -130.05 114.73 16.14 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.653 1.181 . . . . 0.0 110.337 175.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 22.6 t -97.4 154.65 17.33 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 125.142 1.377 . . . . 0.0 110.237 179.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 53.8 m-85 -147.44 156.31 42.75 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.742 1.217 . . . . 0.0 113.979 -169.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 24.0 t -130.09 129.6 43.78 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.795 1.238 . . . . 0.0 108.726 168.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 63.0 m-80 -143.33 121.74 12.38 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.543 1.137 . . . . 0.0 111.209 -178.155 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 23.4 m -76.23 -30.48 57.95 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.89 1.276 . . . . 0.0 110.575 169.28 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.7 m -53.32 134.07 39.81 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 127.608 2.363 . . . . 0.0 113.126 177.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -63.02 -26.15 68.71 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.672 1.589 . . . . 0.0 112.921 -179.076 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.4 t -160.8 161.02 31.9 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.043 1.737 . . . . 0.0 110.475 171.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 38.5 p90 -163.69 158.14 20.04 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.335 1.454 . . . . 0.0 112.031 -169.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.7 t -95.95 133.08 38.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 125.513 1.525 . . . . 0.0 108.178 169.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.32 129.46 45.53 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.445 1.098 . . . . 0.0 108.694 169.264 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 35.2 m120 -125.52 147.75 49.14 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.108 1.363 . . . . 0.0 111.133 179.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 18.9 t90 -122.02 139.39 53.75 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.482 1.113 . . . . 0.0 111.473 176.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -135.44 144.84 46.68 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.496 1.118 . . . . 0.0 113.859 -170.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.4 ttt-85 -106.54 134.97 48.86 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.516 1.126 . . . . 0.0 108.85 167.556 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.95 130.36 34.49 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.679 1.592 . . . . 0.0 110.614 170.643 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 19.0 m -104.31 158.79 31.2 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 126.014 1.725 . . . . 0.0 111.727 179.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -67.71 -17.42 47.65 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 123.986 3.124 . . . . 0.0 113.98 -174.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 70.6 m -80.08 21.94 0.55 Allowed 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 124.33 1.052 . . . . 0.0 112.28 168.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . 0.274 0.9 OUTLIER 54.31 33.85 19.28 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 128.147 2.579 . . . . 0.0 114.561 179.265 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -118.01 158.9 24.12 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.793 1.237 . . . . 0.0 111.397 178.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.3 p -113.0 144.35 42.74 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 125.815 1.646 . . . . 0.0 109.79 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -129.04 130.69 46.91 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 123.636 0.774 . . . . 0.0 111.313 177.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 32.0 ttmt -74.24 121.15 20.82 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.688 1.195 . . . . 0.0 110.355 -178.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 80.2 mt -94.48 -47.57 6.5 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 125.51 1.524 . . . . 0.0 111.911 -170.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -167.84 170.5 10.67 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 127.287 2.235 . . . . 0.0 109.18 -177.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.65 161.78 35.04 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.181 0.992 . . . . 0.0 112.451 -171.124 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -144.18 118.5 5.92 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.872 1.269 . . . . 0.0 111.131 169.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -53.54 155.74 14.7 Favored 'Cis proline' 0 C--N 1.352 0.715 0 CA-C-N 120.027 1.045 . . . . 0.0 112.166 -11.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -72.09 94.53 1.53 Allowed 'General case' 0 CA--C 1.544 0.727 0 CA-C-O 123.223 1.487 . . . . 0.0 111.966 -171.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -78.45 4.91 11.9 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 127.027 2.131 . . . . 0.0 113.967 -173.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 5.0 ppt_? -68.36 -31.58 71.05 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.345 1.458 . . . . 0.0 113.055 174.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.5 m 65.33 -26.21 0.1 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 128.3 2.64 . . . . 0.0 117.435 169.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 56.7 mm-40 -135.71 165.77 33.55 Favored Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 126.683 1.993 . . . . 0.0 110.816 -170.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.16 161.57 45.51 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 123.039 2.493 . . . . 0.0 111.472 171.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 107.41 -0.21 34.92 Favored Glycine 0 CA--C 1.535 1.281 0 C-N-CA 124.932 1.254 . . . . 0.0 113.635 -172.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 50.6 tp60 -63.9 129.11 38.73 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.261 1.424 . . . . 0.0 110.368 169.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -75.82 137.21 40.35 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.605 0.762 . . . . 0.0 110.902 174.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 55.9 p -76.73 -14.49 59.94 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 114.803 1.409 . . . . 0.0 114.803 -173.433 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 12.2 ptp180 -71.57 -29.8 65.14 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 119.486 1.039 . . . . 0.0 113.179 -175.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -93.77 137.42 33.03 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.49 1.116 . . . . 0.0 112.171 -173.173 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 72.1 mtm180 -140.72 151.51 44.56 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.804 1.241 . . . . 0.0 112.607 -179.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 59.0 t -126.51 126.65 69.37 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 126.078 1.751 . . . . 0.0 109.002 169.035 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 99.5 m -118.53 132.55 56.21 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.736 1.614 . . . . 0.0 109.78 176.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.17 141.74 28.32 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.617 1.167 . . . . 0.0 111.949 176.572 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 32.1 mt -97.77 157.98 33.74 Favored Pre-proline 0 CA--C 1.544 0.723 0 C-N-CA 123.749 0.82 . . . . 0.0 111.149 175.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -65.66 -5.02 10.81 Favored 'Trans proline' 0 CA--C 1.541 0.858 0 C-N-CA 123.411 2.741 . . . . 0.0 114.369 177.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -66.53 -25.99 66.93 Favored 'General case' 0 CA--C 1.55 0.947 0 CA-C-N 119.793 1.178 . . . . 0.0 112.428 169.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 86.68 -27.27 5.94 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 125.619 1.58 . . . . 0.0 114.04 178.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -130.91 73.34 1.54 Allowed 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 122.849 1.309 . . . . 0.0 108.664 171.509 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 13.2 t0 178.99 136.57 0.09 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.907 2.083 . . . . 0.0 108.596 -173.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -148.59 152.23 36.4 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.86 0.864 . . . . 0.0 112.773 -168.062 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 -113.62 127.06 55.92 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.169 1.388 . . . . 0.0 109.63 168.387 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 2.4 mpt? -119.1 136.51 54.12 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.622 1.169 . . . . 0.0 109.684 -179.191 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 50.4 p -141.98 147.3 36.74 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 116.122 1.897 . . . . 0.0 116.122 -169.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 21.9 t -103.52 109.09 26.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 126.642 1.977 . . . . 0.0 107.302 170.021 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 91.9 t -76.11 127.55 37.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 124.493 1.117 . . . . 0.0 109.423 175.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 53.6 ttt85 53.88 59.5 4.24 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.147 1.379 . . . . 0.0 110.955 176.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.47 150.7 47.91 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.836 0.854 . . . . 0.0 112.434 -171.537 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.95 162.63 31.53 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.934 1.693 . . . . 0.0 110.686 -179.406 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 76.9 mtm180 -55.88 -22.37 25.11 Favored 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 114.474 1.287 . . . . 0.0 114.474 -177.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -55.28 -37.96 67.98 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.846 1.258 . . . . 0.0 112.835 168.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -80.97 -26.16 36.8 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.215 1.006 . . . . 0.0 113.096 -169.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 46.4 m -49.74 138.41 14.56 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.935 1.294 . . . . 0.0 112.963 178.177 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 155.7 -164.26 32.08 Favored Glycine 0 N--CA 1.472 1.037 0 C-N-CA 123.88 0.753 . . . . 0.0 113.198 -176.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 21.9 m -89.95 144.61 25.77 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.276 1.031 . . . . 0.0 109.293 175.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 34.2 m-85 -135.65 158.36 44.57 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.6 1.56 . . . . 0.0 112.174 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -160.87 151.9 18.74 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 124.953 1.301 . . . . 0.0 112.3 175.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 85.3 m -103.39 170.76 7.76 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.787 1.235 . . . . 0.0 110.969 173.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -164.82 140.24 6.3 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 121.258 -0.901 . . . . 0.0 114.078 172.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -104.34 142.98 33.61 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.562 1.145 . . . . 0.0 111.124 173.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.0 tt -145.47 134.42 17.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 124.209 1.003 . . . . 0.0 111.057 176.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 2.2 m -64.24 160.88 17.66 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.735 1.214 . . . . 0.0 112.828 -179.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 37.2 mt -72.46 -17.57 61.76 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 -178.19 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -69.1 148.92 97.77 Favored Pre-proline 0 CA--C 1.551 0.998 0 C-N-CA 124.522 1.129 . . . . 0.0 112.48 178.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -69.55 -20.29 36.0 Favored 'Trans proline' 0 CA--C 1.539 0.764 0 C-N-CA 123.144 2.563 . . . . 0.0 113.214 179.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -83.04 0.44 44.85 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 124.803 1.241 . . . . 0.0 113.97 178.126 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.9 167.98 14.56 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.126 1.371 . . . . 0.0 113.928 -175.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -145.77 152.01 38.87 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.81 1.644 . . . . 0.0 109.546 177.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 51.2 mt -75.57 126.95 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 124.187 0.995 . . . . 0.0 111.215 -174.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -78.4 88.49 4.4 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.767 1.227 . . . . 0.0 109.967 169.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -83.79 158.78 21.59 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.914 1.285 . . . . 0.0 111.154 175.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 6.7 t -148.61 -170.0 3.5 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.201 1.0 . . . . 0.0 112.152 173.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 98.8 mt -60.5 128.82 38.55 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.193 1.797 . . . . 0.0 111.754 -174.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.43 154.45 41.34 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.758 1.223 . . . . 0.0 112.73 -171.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.84 167.16 11.19 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 127.069 2.148 . . . . 0.0 110.234 174.239 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -135.06 143.41 46.68 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.026 -1.046 . . . . 0.0 111.781 179.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 60.6 tp -112.17 134.14 53.89 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 125.922 1.689 . . . . 0.0 110.3 172.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 70.8 ttt180 -124.87 117.96 25.26 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.501 1.52 . . . . 0.0 109.615 169.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 29.5 t -100.53 117.7 46.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 124.37 1.068 . . . . 0.0 108.685 169.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 66.8 p -97.44 154.65 17.34 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.698 1.599 . . . . 0.0 111.056 179.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -62.02 141.98 57.76 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.527 0.731 . . . . 0.0 112.629 -176.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 51.8 ttt85 -75.84 116.88 17.0 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.914 0.885 . . . . 0.0 110.164 -178.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 44.9 ptt85 -70.61 150.25 46.23 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.761 0.824 . . . . 0.0 113.056 -175.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -89.51 124.85 34.89 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.322 1.049 . . . . 0.0 109.055 168.572 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 . . . . . 0 N--CA 1.487 1.392 0 C-N-CA 128.342 2.657 . . . . 0.0 112.388 -170.98 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 2.1 tmt? . . . . . 0 N--CA 1.488 1.473 0 CA-C-O 118.687 -0.673 . . . . 0.0 110.188 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_endo -83.24 152.12 13.9 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.569 2.846 . . . . 0.0 111.124 177.269 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -65.13 130.78 26.56 Favored 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 122.687 2.258 . . . . 0.0 110.007 172.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 37.8 m -139.8 148.16 41.79 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.926 0.891 . . . . 0.0 111.378 -169.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -116.8 129.23 55.97 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.6 1.96 . . . . 0.0 109.576 170.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 67.8 m -140.79 158.94 64.24 Favored Pre-proline 0 N--CA 1.479 0.98 0 C-N-CA 124.543 1.137 . . . . 0.0 113.14 -170.062 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -67.75 157.5 85.46 Favored 'Cis proline' 0 C--N 1.354 0.833 0 CA-C-N 119.938 1.014 . . . . 0.0 111.398 -5.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -55.03 -25.92 33.67 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.109 0.963 . . . . 0.0 113.5 176.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 43.3 tp -143.5 116.18 8.69 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.582 1.553 . . . . 0.0 108.441 168.698 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 38.0 tp -97.32 127.47 43.31 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.416 1.086 . . . . 0.0 109.018 169.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.8 t -114.04 123.14 69.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 124.067 0.947 . . . . 0.0 108.662 173.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 32.6 m -127.03 162.52 31.72 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 124.529 1.132 . . . . 0.0 112.134 174.013 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 11.6 m -87.52 148.65 24.82 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.378 1.071 . . . . 0.0 110.502 173.076 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -59.2 125.7 24.69 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.019 0.928 . . . . 0.0 111.753 -179.254 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.66 -3.49 85.02 Favored Glycine 0 CA--C 1.532 1.11 0 C-N-CA 125.805 1.669 . . . . 0.0 114.51 -175.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -85.35 156.03 21.07 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 119.601 1.7 . . . . 0.0 110.814 171.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -82.46 134.81 35.22 Favored 'General case' 0 CA--C 1.543 0.68 0 O-C-N 121.405 -0.809 . . . . 0.0 111.24 171.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -104.47 123.64 47.84 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.713 1.605 . . . . 0.0 110.052 177.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 94.7 m -122.9 125.22 44.93 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.41 0.684 . . . . 0.0 110.985 176.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -102.82 159.6 15.34 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 127.264 2.225 . . . . 0.0 110.522 174.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 80.6 m -105.71 130.08 53.79 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.854 1.261 . . . . 0.0 109.997 170.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 54.0 t -110.29 140.5 44.39 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.382 1.473 . . . . 0.0 109.814 168.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 6.1 t -144.38 132.24 21.38 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.355 -0.84 . . . . 0.0 110.534 -178.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -127.32 139.29 52.98 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 125.645 1.578 . . . . 0.0 113.636 -177.217 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 29.3 t -93.58 117.9 30.68 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 165.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 41.2 t-20 -157.13 131.68 8.63 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.684 -0.635 . . . . 0.0 111.762 -169.26 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 29.1 p -91.47 -13.56 32.03 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 126.182 1.793 . . . . 0.0 113.84 -178.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 70.3 m -68.58 129.95 41.43 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.353 1.061 . . . . 0.0 111.507 178.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -63.71 -26.95 68.89 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.05 1.34 . . . . 0.0 112.788 -179.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 21.2 t -151.18 146.19 25.93 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.999 1.319 . . . . 0.0 110.777 171.139 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 52.4 p90 -163.91 159.06 20.52 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.17 1.788 . . . . 0.0 110.611 -175.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 50.4 t -95.92 125.22 48.78 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.43 1.092 . . . . 0.0 108.268 174.098 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 58.6 tp -101.57 128.9 47.62 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.388 0.675 . . . . 0.0 109.557 169.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 28.8 m-80 -116.64 163.17 16.51 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.637 1.575 . . . . 0.0 111.154 -175.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 19.8 t90 -133.19 138.88 46.73 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.756 1.222 . . . . 0.0 111.832 -178.376 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -137.43 146.56 44.51 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.291 1.436 . . . . 0.0 113.717 -172.073 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 27.7 ttp-105 -104.12 142.62 34.17 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.949 1.7 . . . . 0.0 107.727 167.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 35.4 mtp -88.27 131.47 34.77 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 119.077 0.853 . . . . 0.0 111.027 170.075 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 37.9 m -92.65 155.56 41.84 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 124.807 1.243 . . . . 0.0 111.43 175.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -66.67 -19.32 53.88 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 123.566 2.844 . . . . 0.0 113.775 -175.22 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.7 m -76.94 8.54 3.69 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 124.753 1.221 . . . . 0.0 113.277 171.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 26.4 m120 73.29 21.01 3.13 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 127.851 2.46 . . . . 0.0 113.37 179.231 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 21.9 mm100 -96.7 175.37 6.4 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.669 1.187 . . . . 0.0 111.265 174.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.2 p -126.53 139.84 52.9 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.976 1.71 . . . . 0.0 109.795 175.251 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 41.3 t0 -120.57 130.68 54.31 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 125.323 1.449 . . . . 0.0 110.667 -177.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 41.7 tttm -82.79 123.12 29.04 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.454 1.102 . . . . 0.0 111.415 -171.435 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.5 mt -100.37 -45.65 5.51 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.77 1.228 . . . . 0.0 112.912 -169.069 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -174.05 176.71 2.5 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.337 1.855 . . . . 0.0 110.353 -178.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -157.75 166.29 33.15 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.959 1.303 . . . . 0.0 112.136 -179.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 21.2 t80 -142.17 122.24 8.18 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 125.087 1.355 . . . . 0.0 110.503 172.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -60.63 154.42 52.72 Favored 'Cis proline' 0 C--N 1.352 0.715 0 CA-C-N 119.534 0.869 . . . . 0.0 110.92 -9.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -62.68 97.76 0.11 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.611 1.165 . . . . 0.0 114.005 -169.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -77.99 44.19 0.47 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 127.085 2.154 . . . . 0.0 111.125 169.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 16.2 ttt180 -70.79 -1.57 11.99 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 115.019 1.489 . . . . 0.0 115.019 -169.192 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 18.9 m -67.51 -22.5 65.44 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.759 1.224 . . . . 0.0 113.39 174.09 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 64.0 mm-40 -83.35 145.85 49.42 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 123.712 0.805 . . . . 0.0 111.106 175.601 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -76.58 158.24 36.01 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.507 2.805 . . . . 0.0 112.877 -173.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 98.26 -7.18 61.94 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 125.638 1.59 . . . . 0.0 112.911 177.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -92.35 61.13 3.78 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.269 1.028 . . . . 0.0 112.17 -169.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -74.14 160.46 31.18 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 124.695 1.198 . . . . 0.0 113.588 178.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 20.7 m -70.02 -3.66 17.34 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 116.389 1.996 . . . . 0.0 116.389 -168.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 50.6 mtp180 -70.45 -29.66 66.3 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 119.465 1.03 . . . . 0.0 112.049 170.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 88.6 m-85 -103.23 128.3 50.27 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.554 1.542 . . . . 0.0 110.903 -175.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -142.02 148.04 37.86 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.766 1.227 . . . . 0.0 111.406 -170.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 40.9 t -126.62 136.9 59.47 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 124.976 1.311 . . . . 0.0 110.784 178.497 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 98.0 m -127.81 132.74 49.43 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.494 1.518 . . . . 0.0 110.212 175.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -85.12 136.48 33.53 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.08 0.952 . . . . 0.0 110.46 172.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 29.5 mt -89.59 159.25 44.22 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 124.135 0.974 . . . . 0.0 111.461 176.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -63.65 -6.03 9.83 Favored 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 123.489 2.793 . . . . 0.0 114.216 175.097 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -66.55 -18.99 65.67 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-N 119.224 0.92 . . . . 0.0 112.953 169.391 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 82.72 -34.18 2.76 Favored Glycine 0 N--CA 1.474 1.2 0 C-N-CA 127.386 2.422 . . . . 0.0 114.326 174.222 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 38.1 mtm105 -128.25 73.56 1.49 Allowed 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.097 1.359 . . . . 0.0 108.574 168.534 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -174.22 137.68 0.54 Allowed 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 127.743 2.417 . . . . 0.0 108.03 177.514 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -146.03 148.5 32.77 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 123.461 0.705 . . . . 0.0 112.209 -168.037 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 42.6 m170 -105.43 130.2 53.57 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.71 1.204 . . . . 0.0 111.203 169.325 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -112.0 119.31 38.04 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 126.311 1.844 . . . . 0.0 108.565 178.088 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 60.8 m -121.44 125.66 47.42 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 -169.479 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 25.8 t -96.35 111.11 25.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 125.773 1.629 . . . . 0.0 106.693 168.185 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 62.6 t -81.48 127.92 39.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 123.543 0.737 . . . . 0.0 109.766 177.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 68.0 ttt-85 57.15 67.61 0.96 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.821 1.649 . . . . 0.0 111.273 176.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -72.53 144.42 47.97 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.851 0.86 . . . . 0.0 112.289 -174.137 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 49.0 mmm-85 -123.15 162.23 22.91 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 126.625 1.97 . . . . 0.0 110.352 -177.092 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 77.2 mtm180 -55.66 -23.11 26.33 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 113.66 0.985 . . . . 0.0 113.66 174.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -54.06 -35.67 62.28 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.766 1.626 . . . . 0.0 113.586 168.271 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -87.69 -15.09 38.12 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.304 1.042 . . . . 0.0 113.72 -168.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 50.2 m -58.04 134.66 56.61 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 119.696 1.135 . . . . 0.0 112.273 177.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 146.94 -163.97 28.59 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 124.496 1.046 . . . . 0.0 113.316 -171.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.8 m -95.08 144.85 25.4 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.586 1.154 . . . . 0.0 111.783 -173.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -140.5 156.92 46.18 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.394 1.877 . . . . 0.0 112.254 -179.097 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -164.07 159.16 20.19 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.797 1.639 . . . . 0.0 112.372 179.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 7.3 p -112.49 162.99 15.0 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.543 1.137 . . . . 0.0 112.115 176.037 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -153.35 126.23 1.92 Allowed Glycine 0 N--CA 1.471 1.026 0 O-C-N 121.304 -0.872 . . . . 0.0 114.287 -176.569 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -97.23 148.78 22.75 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.484 1.114 . . . . 0.0 112.715 -177.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 17.8 tt -150.27 138.8 14.78 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 125.402 1.481 . . . . 0.0 110.532 175.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 47.4 t -65.2 158.15 26.91 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.451 -0.781 . . . . 0.0 112.72 176.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -71.76 -8.04 51.79 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 172.542 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -69.77 147.59 96.3 Favored Pre-proline 0 CA--C 1.552 1.04 0 C-N-CA 124.453 1.101 . . . . 0.0 112.275 175.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -71.02 -21.24 27.9 Favored 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 123.17 2.58 . . . . 0.0 113.311 -179.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -87.74 3.5 47.78 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.735 1.214 . . . . 0.0 113.821 179.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.76 167.31 17.42 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.147 1.379 . . . . 0.0 114.126 -173.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -150.45 148.86 29.26 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.221 1.808 . . . . 0.0 109.169 178.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 47.8 mt -77.15 131.12 35.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 124.219 1.008 . . . . 0.0 112.031 -170.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -101.32 117.11 34.31 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.594 1.557 . . . . 0.0 108.284 168.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -94.93 148.86 21.87 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.235 1.014 . . . . 0.0 112.134 -174.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 52.9 p -83.91 169.22 15.29 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.693 1.197 . . . . 0.0 114.074 178.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 94.5 mt -69.06 129.99 41.48 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 166.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 34.3 ptt-85 -84.68 164.15 18.79 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.931 1.292 . . . . 0.0 113.749 -169.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -146.93 163.13 37.14 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.283 1.433 . . . . 0.0 113.488 -177.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -99.13 151.48 20.93 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.726 1.61 . . . . 0.0 112.798 -176.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 61.5 tp -125.58 136.49 53.35 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 126.857 2.063 . . . . 0.0 109.851 169.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -128.11 120.46 27.44 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.7 1.6 . . . . 0.0 109.93 174.031 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 42.9 t -101.95 116.93 46.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 124.512 1.125 . . . . 0.0 108.752 169.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 82.8 p -101.98 145.37 29.37 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.653 1.581 . . . . 0.0 110.716 -178.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -55.36 145.22 22.78 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -175.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 63.7 ttt-85 -94.26 141.78 28.17 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 125.209 1.404 . . . . 0.0 109.772 175.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 35.4 ttp-105 -66.18 150.71 48.35 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.905 0.882 . . . . 0.0 110.885 170.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -75.22 102.35 4.97 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.527 0.731 . . . . 0.0 109.666 170.464 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 . . . . . 0 C--O 1.255 1.355 0 C-N-CA 125.563 1.545 . . . . 0.0 112.542 -169.774 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 16.4 tpt . . . . . 0 N--CA 1.49 1.54 0 CA-C-O 116.28 -1.819 . . . . 0.0 113.05 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -61.88 158.04 40.23 Favored 'Trans proline' 0 C--N 1.358 1.072 0 C-N-CA 122.459 2.106 . . . . 0.0 113.218 178.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -59.08 155.55 38.84 Favored 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 123.804 3.003 . . . . 0.0 114.564 175.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.2 t -163.55 159.16 21.61 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.017 1.327 . . . . 0.0 112.202 174.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -144.97 117.67 8.67 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.347 1.859 . . . . 0.0 109.619 175.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 96.9 p -140.94 161.72 52.29 Favored Pre-proline 0 CA--C 1.55 0.969 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 -169.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -71.71 164.26 84.65 Favored 'Cis proline' 0 C--N 1.354 0.826 0 CA-C-N 119.45 0.839 . . . . 0.0 111.762 -7.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.66 -26.06 68.49 Favored 'General case' 0 CA--C 1.544 0.75 0 N-CA-C 113.048 0.759 . . . . 0.0 113.048 173.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 50.7 tp -144.3 125.68 14.8 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.192 1.797 . . . . 0.0 109.326 172.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 64.7 tp -115.29 125.61 53.48 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.987 1.715 . . . . 0.0 109.266 174.304 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.9 t -110.25 122.98 65.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 124.144 0.978 . . . . 0.0 109.16 175.038 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 32.0 m -129.2 176.22 8.75 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 125.753 1.621 . . . . 0.0 111.861 176.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 26.1 m -103.95 151.68 22.88 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 126.08 1.752 . . . . 0.0 110.402 176.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -53.51 121.98 8.82 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.294 1.038 . . . . 0.0 111.777 171.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.0 2.36 69.1 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 125.442 1.496 . . . . 0.0 114.407 -177.089 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -93.85 149.37 21.29 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.665 1.732 . . . . 0.0 112.544 177.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 21.6 m120 -72.93 113.22 9.72 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.255 1.022 . . . . 0.0 110.757 172.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -97.5 124.99 41.92 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.79 0.836 . . . . 0.0 110.514 177.63 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 32.1 m -129.53 123.27 31.02 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 118.633 0.651 . . . . 0.0 111.53 -173.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -101.55 149.81 23.72 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.609 1.564 . . . . 0.0 110.371 169.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 62.1 m -102.67 126.34 49.73 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.985 1.314 . . . . 0.0 109.475 177.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 37.5 t -124.33 142.05 51.58 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.147 1.379 . . . . 0.0 112.314 175.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 80.7 p -150.59 148.79 29.07 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.146 -0.971 . . . . 0.0 112.133 170.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -139.2 156.12 47.33 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.822 2.049 . . . . 0.0 111.962 178.486 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 70.9 m -132.64 142.84 49.29 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.245 1.418 . . . . 0.0 109.247 168.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 53.7 m-80 -137.66 156.26 48.23 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.811 1.245 . . . . 0.0 111.827 -176.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 19.6 p -74.03 -34.0 63.95 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.465 1.506 . . . . 0.0 112.189 174.149 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 13.1 m -65.02 152.14 44.18 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.841 1.656 . . . . 0.0 112.269 172.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -68.61 -14.73 63.2 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 114.741 1.386 . . . . 0.0 114.741 -175.111 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 13.3 m -166.36 159.53 14.84 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 126.529 1.932 . . . . 0.0 111.376 178.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 55.5 p90 -156.62 157.41 35.22 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.878 1.271 . . . . 0.0 112.475 -176.413 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.7 t -96.03 129.02 46.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 125.179 1.392 . . . . 0.0 107.995 170.058 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 34.1 tp -99.37 140.29 33.77 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.222 1.009 . . . . 0.0 109.968 171.294 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -135.49 146.37 48.08 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.337 1.455 . . . . 0.0 111.02 -170.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 17.3 t90 -118.37 139.9 50.67 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.031 1.332 . . . . 0.0 111.297 177.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -136.99 147.7 46.44 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.725 1.21 . . . . 0.0 113.783 -172.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 74.4 ttt180 -105.68 140.06 39.31 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.41 1.484 . . . . 0.0 108.315 167.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 29.8 mtp -81.82 145.92 30.16 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.011 0.823 . . . . 0.0 112.414 177.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 67.7 m -104.68 148.91 36.83 Favored Pre-proline 0 CA--C 1.544 0.745 0 C-N-CA 125.657 1.583 . . . . 0.0 110.793 173.408 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -67.16 -17.9 50.73 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 123.682 2.921 . . . . 0.0 113.278 -177.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 12.0 m -76.87 19.25 0.3 Allowed 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 125.759 1.624 . . . . 0.0 113.29 171.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 44.8 m-80 68.63 33.84 3.72 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 127.425 2.29 . . . . 0.0 112.587 177.01 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -130.06 -172.68 2.84 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.453 1.501 . . . . 0.0 110.798 -172.121 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.1 p -148.01 145.12 28.38 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.909 1.684 . . . . 0.0 110.215 -171.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -120.12 131.61 55.11 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 124.638 1.175 . . . . 0.0 111.002 175.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -76.17 129.51 36.85 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.561 0.744 . . . . 0.0 111.307 -179.359 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 55.7 mt -101.98 -51.25 3.45 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 125.473 1.509 . . . . 0.0 111.406 -173.165 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -163.4 173.55 13.05 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.822 1.649 . . . . 0.0 110.387 -175.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.6 168.39 26.21 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.508 1.123 . . . . 0.0 112.759 -174.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 52.3 t80 -142.73 122.8 7.98 Favored Pre-proline 0 CA--C 1.546 0.8 0 C-N-CA 124.992 1.317 . . . . 0.0 110.332 169.439 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -62.92 159.33 61.83 Favored 'Cis proline' 0 C--N 1.351 0.705 0 CA-C-N 119.683 0.922 . . . . 0.0 111.399 -8.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -76.59 94.64 3.78 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 121.932 0.873 . . . . 0.0 110.997 -177.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -82.4 0.88 40.0 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.889 1.676 . . . . 0.0 114.225 -177.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 52.3 ptt85 -63.91 -23.63 67.42 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.717 1.607 . . . . 0.0 114.253 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 25.3 p 69.71 -35.28 0.31 Allowed 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 129.333 3.053 . . . . 0.0 115.464 177.587 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -135.74 161.92 60.0 Favored Pre-proline 0 CA--C 1.546 0.811 0 C-N-CA 126.104 1.762 . . . . 0.0 111.485 -169.306 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -79.8 -177.44 3.84 Favored 'Trans proline' 0 CA--C 1.542 0.91 0 C-N-CA 124.313 3.342 . . . . 0.0 111.557 172.233 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 121.9 -5.06 10.58 Favored Glycine 0 CA--C 1.534 1.239 0 C-N-CA 124.995 1.283 . . . . 0.0 114.772 176.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -80.22 164.84 22.94 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.147 0.979 . . . . 0.0 111.916 171.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -73.41 157.74 36.31 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.359 1.064 . . . . 0.0 112.92 172.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 17.7 m -80.33 -7.88 59.25 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 115.517 1.673 . . . . 0.0 115.517 -169.693 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -69.54 -47.48 63.56 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 119.706 1.139 . . . . 0.0 113.693 -169.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -90.15 124.94 35.25 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.04 0.936 . . . . 0.0 112.944 -168.111 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 23.4 mmt85 -129.82 156.63 44.03 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.84 1.656 . . . . 0.0 111.831 178.137 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 87.7 t -126.6 130.53 71.69 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 C-N-CA 125.65 1.58 . . . . 0.0 109.771 169.774 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 97.8 m -126.0 132.0 52.11 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 125.08 1.352 . . . . 0.0 110.16 177.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 63.0 tt0 -84.64 138.02 32.93 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.597 1.159 . . . . 0.0 111.043 177.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 28.6 mt -91.55 162.37 31.78 Favored Pre-proline 0 CA--C 1.548 0.877 0 C-N-CA 124.102 0.961 . . . . 0.0 112.063 176.31 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -56.03 -20.88 32.02 Favored 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 124.213 3.276 . . . . 0.0 114.211 172.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 21.7 m120 -60.74 -18.44 54.6 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 176.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 90.48 -34.06 4.32 Favored Glycine 0 N--CA 1.474 1.196 0 C-N-CA 126.569 2.033 . . . . 0.0 114.549 169.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 26.0 ptt-85 -138.8 73.58 1.44 Allowed 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 123.883 1.802 . . . . 0.0 109.72 168.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -164.53 137.33 4.84 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 127.872 2.469 . . . . 0.0 106.52 -179.058 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -144.75 143.47 30.69 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -166.628 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -96.69 116.03 28.43 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.973 1.309 . . . . 0.0 110.322 168.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -94.55 108.05 20.01 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 126.558 1.943 . . . . 0.0 107.621 174.336 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 19.4 m -116.51 126.99 54.14 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.847 1.055 . . . . 0.0 113.847 -167.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 21.3 t -94.66 104.83 16.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 N-CA-C 106.722 -1.584 . . . . 0.0 106.722 168.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 81.0 t -70.4 121.08 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 124.647 1.179 . . . . 0.0 109.731 179.442 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 51.87 57.27 6.7 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.793 1.637 . . . . 0.0 112.039 176.32 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -59.57 140.04 56.66 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.254 1.422 . . . . 0.0 112.056 -173.086 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 19.8 mmm-85 -115.05 168.31 10.04 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.641 1.576 . . . . 0.0 110.508 177.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 59.0 mtp85 -51.2 -35.29 35.78 Favored 'General case' 0 N--CA 1.479 0.997 0 O-C-N 121.023 -1.048 . . . . 0.0 112.855 176.149 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -57.43 -22.59 44.26 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.14 1.776 . . . . 0.0 114.994 173.115 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -86.68 -10.88 52.78 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.774 1.229 . . . . 0.0 113.53 177.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 65.4 m -63.97 137.74 58.14 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 120.196 -1.565 . . . . 0.0 112.312 -179.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 152.23 -166.7 31.14 Favored Glycine 0 N--CA 1.47 0.901 0 C-N-CA 123.996 0.808 . . . . 0.0 113.298 -179.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.6 m -93.63 141.79 28.08 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.367 1.067 . . . . 0.0 110.467 -176.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -136.05 160.12 39.6 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.548 1.939 . . . . 0.0 110.972 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.7 pp -154.09 163.52 39.96 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 121.12 -0.988 . . . . 0.0 112.262 174.036 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 34.6 t -124.59 141.18 52.29 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.288 1.435 . . . . 0.0 110.494 -177.125 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -150.24 143.78 11.11 Favored Glycine 0 N--CA 1.47 0.96 0 N-CA-C 114.938 0.735 . . . . 0.0 114.938 -175.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -115.86 154.3 29.96 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.009 1.324 . . . . 0.0 113.04 -177.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 17.2 tt -146.64 133.29 13.85 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 125.344 1.458 . . . . 0.0 110.469 176.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 31.7 p -71.47 161.55 30.85 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.124 0.97 . . . . 0.0 113.427 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 47.3 mt -75.22 -3.42 32.98 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 114.233 1.197 . . . . 0.0 114.233 -179.047 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -67.8 151.69 96.97 Favored Pre-proline 0 CA--C 1.551 0.986 0 C-N-CA 124.729 1.212 . . . . 0.0 112.612 178.193 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -69.29 -23.9 32.43 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 122.939 2.426 . . . . 0.0 112.693 175.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 57.2 mtmt -92.39 10.28 30.61 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.247 1.419 . . . . 0.0 113.591 178.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -64.23 161.62 16.18 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.815 1.246 . . . . 0.0 114.014 -175.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 25.9 tt0 -147.07 149.02 32.26 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.02 1.728 . . . . 0.0 109.105 179.037 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 58.1 mt -77.21 123.93 34.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 123.181 0.592 . . . . 0.0 110.967 -176.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -93.99 137.84 32.76 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.506 1.522 . . . . 0.0 108.709 168.19 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -120.06 142.41 48.88 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.098 0.959 . . . . 0.0 111.797 -175.29 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 23.7 m -89.65 167.13 13.16 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.192 0.997 . . . . 0.0 112.251 169.56 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.4 139.38 58.21 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.12 0.968 . . . . 0.0 110.665 176.202 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.57 151.88 44.55 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -172.838 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.87 161.12 19.25 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.062 1.745 . . . . 0.0 111.347 174.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -120.95 135.46 55.2 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.036 1.334 . . . . 0.0 110.016 176.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 46.3 tp -107.79 128.82 54.93 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 125.622 1.569 . . . . 0.0 109.724 173.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 4.5 tpm_? -123.83 113.14 18.14 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.122 1.769 . . . . 0.0 109.203 177.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 16.3 t -106.85 114.48 46.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 123.628 0.771 . . . . 0.0 109.799 176.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 70.2 p -95.25 159.27 15.09 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.43 1.892 . . . . 0.0 111.593 -176.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -67.57 141.48 56.8 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.433 0.693 . . . . 0.0 112.168 -178.184 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 68.9 ttp85 -84.1 131.37 34.8 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 124.419 1.088 . . . . 0.0 110.113 178.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 65.9 ttp85 -71.33 141.41 50.45 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.7 0.8 . . . . 0.0 111.495 179.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -73.8 154.32 39.58 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.551 1.14 . . . . 0.0 112.667 176.173 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 2.4 pp20? . . . . . 0 C--O 1.253 1.271 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 177.864 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 24.9 ptp . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 118.416 -0.802 . . . . 0.0 111.226 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -76.92 170.22 20.22 Favored 'Trans proline' 0 CA--C 1.545 1.07 0 C-N-CA 123.638 2.892 . . . . 0.0 111.811 174.311 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -55.18 153.58 26.22 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 124.244 3.296 . . . . 0.0 112.971 169.466 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 13.7 t -147.93 153.95 39.72 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.041 0.936 . . . . 0.0 112.023 -179.254 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -143.92 113.88 7.27 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 127.535 2.334 . . . . 0.0 107.982 178.332 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 95.1 p -140.83 159.61 61.71 Favored Pre-proline 0 CA--C 1.55 0.951 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 -168.662 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.22 161.72 84.06 Favored 'Cis proline' 0 C--N 1.355 0.916 0 CA-C-N 119.419 0.828 . . . . 0.0 111.598 -6.73 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.43 -27.86 69.29 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 175.062 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 tt -132.57 115.36 15.36 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 126.453 1.901 . . . . 0.0 108.71 173.847 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.7 tp -107.15 121.18 43.99 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.933 0.893 . . . . 0.0 109.63 172.092 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.0 t -106.38 125.54 62.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 124.132 0.973 . . . . 0.0 108.661 172.737 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.9 m -129.42 166.67 26.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 124.363 1.065 . . . . 0.0 111.422 169.804 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 73.6 m -88.76 150.33 23.0 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.26 1.024 . . . . 0.0 110.344 170.424 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -53.81 116.9 2.77 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.551 1.541 . . . . 0.0 111.313 173.335 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 89.67 8.31 67.82 Favored Glycine 0 CA--C 1.534 1.247 0 CA-C-O 118.547 -1.141 . . . . 0.0 114.62 -176.295 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -99.5 155.34 17.62 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 119.408 1.604 . . . . 0.0 111.96 171.484 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -78.5 119.56 21.96 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.99 0.916 . . . . 0.0 110.969 179.895 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -98.91 126.72 44.66 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.685 1.194 . . . . 0.0 110.749 175.941 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 97.7 m -132.78 125.6 30.49 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.774 0.83 . . . . 0.0 111.61 179.74 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -100.05 154.16 18.64 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.837 1.655 . . . . 0.0 109.441 168.191 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.3 m -106.52 134.26 49.93 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.689 1.195 . . . . 0.0 109.369 173.493 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 43.2 t -126.39 139.63 53.12 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.637 1.575 . . . . 0.0 111.959 176.156 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 99.2 p -151.23 153.38 34.79 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 121.437 -0.79 . . . . 0.0 112.132 170.594 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -130.58 156.14 45.36 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.787 1.635 . . . . 0.0 113.336 -174.778 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.8 m -113.19 116.2 29.43 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.106 1.363 . . . . 0.0 109.348 169.661 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 75.7 m-20 -139.36 140.2 37.41 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.5 1.52 . . . . 0.0 110.606 179.621 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 23.9 p -80.09 -21.53 43.22 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 125.807 1.643 . . . . 0.0 113.642 -175.755 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 32.0 p -74.94 165.22 25.6 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.121 1.369 . . . . 0.0 111.345 169.329 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -68.22 -31.72 71.43 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.279 1.432 . . . . 0.0 112.836 -173.436 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.3 t -163.12 171.03 16.97 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.903 1.281 . . . . 0.0 111.828 -176.504 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 35.6 p90 -161.09 162.46 31.59 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 126.185 1.794 . . . . 0.0 110.784 -170.02 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 79.2 t -95.87 123.14 47.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 170.091 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 22.3 tp -100.06 136.12 40.45 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.908 0.883 . . . . 0.0 109.776 176.564 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -130.71 154.69 47.68 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.689 1.596 . . . . 0.0 111.003 -169.746 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 19.3 t90 -130.9 137.68 49.43 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.755 1.222 . . . . 0.0 111.689 -177.351 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -136.15 146.43 46.89 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.53 1.132 . . . . 0.0 112.998 -173.058 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.6 ttt180 -103.71 140.88 37.0 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.962 1.305 . . . . 0.0 108.48 167.823 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 28.5 mtp -87.08 140.75 29.24 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.4 0.68 . . . . 0.0 111.931 176.719 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 48.6 m -91.94 157.62 40.98 Favored Pre-proline 0 CA--C 1.549 0.913 0 C-N-CA 124.714 1.206 . . . . 0.0 111.91 176.514 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -55.62 -34.01 88.85 Favored 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 123.957 3.104 . . . . 0.0 114.09 176.485 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.6 m -76.92 9.63 2.8 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.063 1.345 . . . . 0.0 113.855 176.935 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 26.5 m120 70.5 20.9 5.74 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 127.329 2.252 . . . . 0.0 113.386 -178.971 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -90.1 -172.67 3.57 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.555 1.142 . . . . 0.0 110.582 170.432 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.1 p -145.13 147.35 32.4 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.768 1.627 . . . . 0.0 110.488 -175.512 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -123.9 133.3 53.77 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 124.731 1.212 . . . . 0.0 111.235 174.16 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -79.92 118.8 22.0 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.916 0.886 . . . . 0.0 111.21 -178.03 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 61.8 mt -89.25 -53.75 4.42 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 125.002 1.321 . . . . 0.0 111.172 -173.709 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -165.4 172.15 12.55 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.854 1.662 . . . . 0.0 110.552 -174.797 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.59 167.81 27.6 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.27 1.428 . . . . 0.0 111.628 -178.094 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -156.22 135.08 7.67 Favored Pre-proline 0 CA--C 1.551 1.011 0 C-N-CA 123.998 0.919 . . . . 0.0 112.974 170.239 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -64.37 139.58 37.3 Favored 'Cis proline' 0 C--N 1.354 0.817 0 N-CA-C 108.98 -1.2 . . . . 0.0 108.98 -14.322 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -78.39 94.64 4.91 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 122.712 1.244 . . . . 0.0 113.218 -167.778 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -73.98 -5.47 41.5 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.177 1.391 . . . . 0.0 112.673 169.768 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 18.6 ttt180 -53.73 -52.74 59.16 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 127.444 2.298 . . . . 0.0 112.589 177.674 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.5 t 69.22 -47.69 0.59 Allowed 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 127.551 2.34 . . . . 0.0 114.558 -179.825 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -90.03 150.68 43.97 Favored Pre-proline 0 CA--C 1.548 0.883 0 C-N-CA 125.226 1.41 . . . . 0.0 112.924 -172.132 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_exo -62.03 -172.82 0.11 Allowed 'Trans proline' 0 CA--C 1.542 0.917 0 C-N-CA 124.535 3.49 . . . . 0.0 114.57 170.134 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 129.03 -12.63 6.09 Favored Glycine 0 N--CA 1.474 1.196 0 C-N-CA 125.534 1.54 . . . . 0.0 113.869 171.482 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -88.55 167.86 13.06 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.853 1.261 . . . . 0.0 111.775 169.868 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -93.99 151.37 19.59 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.621 0.769 . . . . 0.0 109.74 167.197 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 16.1 m -66.73 -7.82 23.69 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 -173.394 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 25.7 ptt-85 -84.37 -16.88 41.26 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 114.694 1.368 . . . . 0.0 114.694 179.034 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -91.02 117.74 29.82 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.47 1.108 . . . . 0.0 110.317 177.805 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -139.09 152.31 47.41 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.417 1.087 . . . . 0.0 112.343 -169.49 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 82.4 t -126.47 128.94 71.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 C-N-CA 125.841 1.656 . . . . 0.0 109.376 177.647 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 96.7 m -128.0 133.47 49.16 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.233 1.413 . . . . 0.0 110.332 -176.466 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -80.65 141.79 34.61 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.001 0.92 . . . . 0.0 112.136 176.608 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 27.2 mt -90.84 158.39 42.21 Favored Pre-proline 0 CA--C 1.545 0.764 0 C-N-CA 124.06 0.944 . . . . 0.0 111.456 172.172 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -65.23 -6.21 12.73 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.529 2.819 . . . . 0.0 114.18 174.623 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -63.0 -26.0 68.65 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 119.527 1.058 . . . . 0.0 112.66 169.436 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 98.69 -34.16 5.53 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 126.231 1.872 . . . . 0.0 114.379 172.611 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 40.6 mtm180 -136.22 73.65 1.47 Allowed 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 118.654 1.227 . . . . 0.0 109.837 170.41 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -168.81 139.83 2.49 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 128.254 2.622 . . . . 0.0 107.397 -176.861 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -143.44 149.85 38.19 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 114.457 1.28 . . . . 0.0 114.457 -167.92 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -102.08 128.67 48.45 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.622 1.569 . . . . 0.0 110.45 168.286 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -106.49 113.11 26.43 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 127.039 2.136 . . . . 0.0 108.071 176.11 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 52.9 m -121.88 132.42 54.56 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 114.817 1.414 . . . . 0.0 114.817 -167.763 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 21.9 t -102.04 104.43 16.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 167.469 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 88.1 t -69.59 126.99 30.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 123.725 0.81 . . . . 0.0 109.858 179.124 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 47.17 59.28 4.15 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.878 1.671 . . . . 0.0 112.327 177.854 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -59.92 137.7 58.01 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.049 1.34 . . . . 0.0 112.737 -170.018 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 36.5 mtp180 -100.01 158.49 15.79 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.914 1.685 . . . . 0.0 109.889 -176.91 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 20.1 mtp180 -58.92 -29.08 66.82 Favored 'General case' 0 N--CA 1.484 1.236 0 O-C-N 120.846 -1.159 . . . . 0.0 112.576 176.039 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -51.23 -30.53 17.72 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.534 1.934 . . . . 0.0 113.948 168.559 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 47.4 m-20 -90.3 -8.89 49.74 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.893 1.277 . . . . 0.0 113.119 -169.693 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 50.4 m -62.98 138.88 58.69 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.058 -1.026 . . . . 0.0 112.202 177.302 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 149.72 -170.15 29.87 Favored Glycine 0 N--CA 1.472 1.095 0 C-N-CA 124.669 1.128 . . . . 0.0 113.0 -177.029 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.6 m -89.34 140.98 28.96 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.136 0.974 . . . . 0.0 110.698 -177.517 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -132.15 160.98 34.46 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.949 2.1 . . . . 0.0 110.478 176.702 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -156.64 161.57 39.89 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.676 1.19 . . . . 0.0 112.33 175.496 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 23.6 t -113.81 151.36 32.17 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.685 1.594 . . . . 0.0 111.093 -178.006 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -152.57 136.8 5.56 Favored Glycine 0 N--CA 1.473 1.165 0 C-N-CA 124.082 0.848 . . . . 0.0 113.688 -179.529 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -111.33 153.81 25.44 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 118.352 1.076 . . . . 0.0 112.659 -179.22 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.8 tt -141.19 132.56 28.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.664 1.186 . . . . 0.0 110.44 170.414 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 29.6 t -65.22 161.57 19.04 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.805 1.242 . . . . 0.0 113.85 -175.216 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 3.1 pp -64.38 -12.65 44.83 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.445 1.498 . . . . 0.0 114.971 176.654 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -78.42 141.11 60.88 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 124.401 1.081 . . . . 0.0 112.398 -178.514 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_exo -56.59 -28.78 76.26 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.409 2.739 . . . . 0.0 114.319 173.203 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -81.92 -1.52 48.17 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.259 1.424 . . . . 0.0 113.861 -178.947 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.03 164.65 12.42 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 114.387 1.254 . . . . 0.0 114.387 -174.478 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -145.03 154.78 42.88 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.419 1.888 . . . . 0.0 108.81 176.466 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 55.8 mt -72.86 121.63 23.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 123.62 0.768 . . . . 0.0 111.328 -173.887 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -92.72 123.61 36.12 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.084 1.754 . . . . 0.0 108.944 169.071 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -87.31 145.2 26.44 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.818 0.847 . . . . 0.0 111.96 -179.005 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 5.2 t -92.77 -165.45 1.34 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.055 1.342 . . . . 0.0 112.002 170.065 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 87.3 mt -68.2 158.94 32.13 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.015 1.326 . . . . 0.0 111.206 169.895 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.29 147.46 31.42 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.76 1.224 . . . . 0.0 111.209 170.14 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -144.3 155.77 43.97 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.588 1.555 . . . . 0.0 111.342 -177.734 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -102.87 141.39 35.75 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 178.582 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 54.7 tp -99.6 131.75 45.39 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 126.836 2.054 . . . . 0.0 108.662 168.956 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 28.7 ttm180 -127.28 110.84 13.25 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.703 1.601 . . . . 0.0 109.429 -179.989 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 42.6 t -101.37 116.47 45.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 124.501 1.12 . . . . 0.0 108.84 177.519 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 72.8 p -98.1 147.79 24.2 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.628 1.571 . . . . 0.0 110.652 -178.635 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -59.53 139.81 56.82 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.267 0.627 . . . . 0.0 111.76 -177.824 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 79.1 ttt-85 -76.8 107.16 8.92 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.794 0.837 . . . . 0.0 110.311 -178.397 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -78.6 163.03 25.84 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.978 1.311 . . . . 0.0 112.861 -179.002 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -69.93 154.35 42.07 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.401 1.08 . . . . 0.0 112.541 175.151 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 . . . . . 0 C--O 1.254 1.29 0 C-N-CA 125.186 1.394 . . . . 0.0 112.923 177.337 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 57.9 ttm . . . . . 0 N--CA 1.49 1.539 0 CA-C-O 118.437 -0.792 . . . . 0.0 110.292 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -61.41 -41.53 40.41 Favored 'Trans proline' 0 CA--C 1.544 0.995 0 C-N-CA 123.37 2.714 . . . . 0.0 115.824 -177.696 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -61.32 123.8 13.51 Favored 'Trans proline' 0 C--N 1.356 0.964 0 C-N-CA 122.625 2.217 . . . . 0.0 112.369 178.219 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.7 t -167.74 156.79 9.71 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.394 1.477 . . . . 0.0 111.576 -178.541 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -161.85 111.99 1.59 Allowed 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 126.034 1.734 . . . . 0.0 109.873 177.584 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 90.0 p -141.03 161.55 53.06 Favored Pre-proline 0 CA--C 1.549 0.918 0 C-N-CA 124.618 1.167 . . . . 0.0 114.097 -174.643 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -75.71 162.83 91.61 Favored 'Cis proline' 0 C--N 1.352 0.746 0 CA-C-N 118.952 0.662 . . . . 0.0 111.456 -10.073 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.69 -25.88 67.52 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 171.868 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 40.4 tp -140.51 118.83 12.1 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 125.907 1.683 . . . . 0.0 109.012 170.688 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 50.6 tp -103.56 129.64 50.83 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.817 1.247 . . . . 0.0 109.127 169.971 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 14.0 p -112.78 128.99 69.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 123.931 0.892 . . . . 0.0 110.271 170.05 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 27.5 m -128.47 166.43 25.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 125.47 1.508 . . . . 0.0 111.865 172.911 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.6 m -90.98 148.43 22.42 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.828 1.251 . . . . 0.0 110.38 173.511 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -54.24 122.03 9.45 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.395 1.478 . . . . 0.0 111.533 176.906 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.73 -1.44 78.47 Favored Glycine 0 CA--C 1.535 1.303 0 C-N-CA 125.585 1.564 . . . . 0.0 114.897 -176.972 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -88.94 159.41 17.66 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.439 1.62 . . . . 0.0 111.381 171.748 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -87.84 135.06 33.55 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.533 -0.729 . . . . 0.0 111.474 171.476 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -108.02 129.91 55.1 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.909 1.683 . . . . 0.0 110.534 179.346 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 39.5 m -132.88 130.22 39.42 Favored 'General case' 0 N--CA 1.476 0.866 0 CA-C-N 119.256 0.935 . . . . 0.0 112.032 178.908 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -102.03 157.66 16.71 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.798 2.039 . . . . 0.0 110.894 172.259 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 46.8 m -113.02 139.75 48.41 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 125.994 1.718 . . . . 0.0 110.058 178.571 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 53.6 t -150.34 149.36 29.98 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.068 1.347 . . . . 0.0 113.08 -177.608 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 8.1 t -154.1 161.76 41.67 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.597 1.159 . . . . 0.0 112.56 169.38 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -142.1 156.31 45.38 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.946 2.098 . . . . 0.0 112.228 -178.314 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 45.6 m -83.35 108.44 16.54 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 106.165 -1.791 . . . . 0.0 106.165 166.267 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 34.2 m120 -78.9 87.11 4.75 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-O 121.689 0.757 . . . . 0.0 112.049 -168.941 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 17.6 p -77.71 -15.49 59.11 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.772 2.029 . . . . 0.0 113.426 175.714 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 63.2 m -83.5 132.53 34.94 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.804 1.242 . . . . 0.0 110.284 170.31 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.4 tm-20 -62.45 -34.53 76.98 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.644 1.177 . . . . 0.0 111.923 179.367 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 9.9 t -152.23 149.74 29.05 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 125.747 1.619 . . . . 0.0 109.12 169.286 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 54.6 p90 -159.53 163.4 35.22 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 -167.586 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.1 t -106.87 136.57 41.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 126.1 1.76 . . . . 0.0 106.917 167.689 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.6 tt -109.64 134.94 51.36 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.509 0.723 . . . . 0.0 109.777 174.845 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -133.35 160.92 35.92 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -166.14 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 67.2 t-105 -115.54 131.65 56.87 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 126.532 1.933 . . . . 0.0 110.877 169.593 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -122.53 156.29 34.48 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.052 1.341 . . . . 0.0 111.956 179.298 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 43.6 ttt-85 -112.84 142.84 45.03 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 126.06 1.744 . . . . 0.0 109.871 169.451 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 67.2 mmm -75.78 142.52 42.3 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.84 0.856 . . . . 0.0 112.384 173.843 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.7 p -90.76 163.61 29.41 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 124.585 1.154 . . . . 0.0 111.101 168.698 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -69.66 -11.09 30.23 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 122.903 2.402 . . . . 0.0 113.086 173.204 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.0 t -94.78 8.09 43.74 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.879 1.272 . . . . 0.0 112.401 172.883 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 64.2 t30 68.84 21.89 7.46 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.744 2.018 . . . . 0.0 113.096 -178.635 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -93.19 -175.05 3.72 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.286 1.034 . . . . 0.0 109.502 169.382 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 11.9 p -138.94 150.41 45.88 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.278 1.031 . . . . 0.0 112.004 -172.859 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -133.96 133.8 41.79 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.081 0.953 . . . . 0.0 111.816 173.403 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -77.3 127.91 33.41 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.735 0.814 . . . . 0.0 111.502 -178.019 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 18.9 mt -106.56 -32.07 8.22 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.901 0.881 . . . . 0.0 113.296 178.65 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -154.57 161.45 41.61 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.303 1.441 . . . . 0.0 111.87 -177.056 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.57 166.31 31.05 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.503 1.121 . . . . 0.0 113.23 -179.133 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -144.24 114.28 5.31 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 126.544 1.937 . . . . 0.0 109.597 174.619 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo -57.52 155.08 32.33 Favored 'Cis proline' 0 CA--C 1.538 0.707 0 CA-C-N 119.546 0.874 . . . . 0.0 112.761 -11.128 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -73.62 128.88 36.72 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.465 0.65 . . . . 0.0 112.536 178.951 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 23.1 p-10 -100.83 8.77 43.01 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 126.668 1.987 . . . . 0.0 112.754 169.723 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 50.3 mtm180 -73.54 14.38 0.36 Allowed 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.112 2.165 . . . . 0.0 115.867 -169.729 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 21.8 t -65.49 -28.26 69.07 Favored 'General case' 0 CA--C 1.548 0.869 0 O-C-N 121.096 -1.002 . . . . 0.0 111.79 169.168 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 62.3 mm-40 -75.44 142.56 74.75 Favored Pre-proline 0 CA--C 1.549 0.93 0 O-C-N 121.134 -0.979 . . . . 0.0 111.039 171.84 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -56.91 158.09 18.2 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 124.471 3.448 . . . . 0.0 115.257 -179.162 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 101.78 19.25 15.82 Favored Glycine 0 CA--C 1.532 1.133 0 C-N-CA 125.164 1.364 . . . . 0.0 113.811 177.753 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.8 pm0 -93.17 160.26 14.92 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.473 1.509 . . . . 0.0 113.343 -176.066 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -142.86 108.74 5.16 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.303 1.441 . . . . 0.0 109.475 168.999 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 17.1 m -62.02 -13.54 26.93 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.378 1.471 . . . . 0.0 114.437 -174.452 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 36.3 mtp-105 -63.37 -29.29 70.62 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 125.07 1.348 . . . . 0.0 112.682 172.574 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -85.21 139.32 31.75 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.444 1.098 . . . . 0.0 109.808 171.935 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 83.2 mtm180 -144.44 149.36 35.9 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.25 1.42 . . . . 0.0 111.605 -173.568 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 77.8 t -126.54 130.93 71.76 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 125.377 1.471 . . . . 0.0 108.409 168.988 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 58.7 m -128.82 138.76 52.24 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.871 1.268 . . . . 0.0 110.59 -174.85 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 27.0 tt0 -97.86 136.62 37.9 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.689 1.195 . . . . 0.0 110.215 170.898 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -97.36 159.87 30.19 Favored Pre-proline 0 CA--C 1.546 0.812 0 C-N-CA 125.427 1.491 . . . . 0.0 111.489 -170.431 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -66.68 -11.1 30.5 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 123.593 2.862 . . . . 0.0 114.056 -178.405 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 22.2 m120 -66.29 -19.33 65.79 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 119.087 0.858 . . . . 0.0 113.052 170.548 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 91.16 -33.87 4.53 Favored Glycine 0 N--CA 1.474 1.229 0 C-N-CA 126.391 1.948 . . . . 0.0 114.377 169.934 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 95.4 mtm-85 -129.06 73.72 1.53 Allowed 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.718 1.607 . . . . 0.0 108.659 169.594 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -170.15 141.6 2.13 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 127.341 2.257 . . . . 0.0 109.278 -178.787 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -145.46 150.36 36.34 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.624 0.726 . . . . 0.0 112.613 -169.725 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -118.98 149.49 41.53 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.421 1.488 . . . . 0.0 111.373 171.321 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.5 mpt? -128.4 124.93 37.54 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.191 0.996 . . . . 0.0 109.358 171.37 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.1 t -124.6 148.29 47.96 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -168.817 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 17.0 t -125.09 105.94 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 127.128 2.171 . . . . 0.0 107.817 176.001 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 96.1 t -80.06 131.43 34.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 124.362 1.065 . . . . 0.0 111.152 -174.997 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 48.8 ttt85 53.4 61.3 3.2 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.917 1.687 . . . . 0.0 111.278 176.002 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.4 129.31 39.56 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.426 1.091 . . . . 0.0 110.844 -172.964 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 12.7 mmt-85 -100.6 167.99 9.99 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.765 1.626 . . . . 0.0 109.511 174.464 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 90.9 mtm-85 -55.56 -34.47 64.78 Favored 'General case' 0 N--CA 1.479 1.015 0 O-C-N 120.922 -1.111 . . . . 0.0 113.009 -178.877 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 34.5 t30 -62.1 -23.79 66.74 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.395 1.478 . . . . 0.0 114.514 174.87 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -80.36 -5.72 56.86 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.087 0.955 . . . . 0.0 112.82 176.258 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 24.4 m -65.49 136.43 56.42 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 120.405 -1.434 . . . . 0.0 110.99 169.943 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 160.07 -165.44 34.76 Favored Glycine 0 N--CA 1.467 0.732 0 O-C-N 121.558 -0.714 . . . . 0.0 113.241 -177.267 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.1 m -107.87 132.22 53.68 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.088 0.955 . . . . 0.0 110.338 -175.933 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -140.71 168.11 20.58 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.661 1.585 . . . . 0.0 111.759 -174.123 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -159.99 151.02 19.25 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 115.013 1.486 . . . . 0.0 115.013 -177.034 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 46.4 t -88.77 136.96 32.73 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.964 2.106 . . . . 0.0 111.275 173.814 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -159.02 135.19 4.08 Favored Glycine 0 N--CA 1.475 1.249 0 N-CA-C 115.402 0.921 . . . . 0.0 115.402 174.859 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -99.0 159.21 15.12 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.34 1.456 . . . . 0.0 112.501 176.393 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 19.0 tt -150.97 134.78 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 125.245 1.418 . . . . 0.0 110.749 178.539 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 41.7 t -64.69 159.66 21.65 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.057 0.943 . . . . 0.0 113.105 177.279 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 44.1 mt -75.51 -12.15 60.17 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.298 0.851 . . . . 0.0 113.298 172.324 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -65.14 147.01 98.84 Favored Pre-proline 0 CA--C 1.552 1.03 0 C-N-CA 124.036 0.934 . . . . 0.0 112.775 -179.432 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -56.5 -30.32 81.91 Favored 'Trans proline' 0 C--N 1.354 0.836 0 C-N-CA 123.511 2.807 . . . . 0.0 114.208 174.142 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 60.2 mtpt -88.35 5.98 39.43 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.193 1.397 . . . . 0.0 113.975 -178.197 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -61.18 153.31 26.33 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 -173.617 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -137.06 159.05 43.04 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.396 1.878 . . . . 0.0 108.744 174.365 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 45.2 mt -78.82 123.7 36.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 O-C-N 121.72 -0.613 . . . . 0.0 110.572 -175.939 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -97.03 104.06 16.04 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 126.106 1.762 . . . . 0.0 108.251 169.065 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -123.06 158.81 29.78 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.994 1.318 . . . . 0.0 113.868 -169.056 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 53.3 m -97.92 159.08 15.16 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.373 1.069 . . . . 0.0 112.14 171.748 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 10.6 mp -63.7 130.39 44.03 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.951 0.9 . . . . 0.0 110.953 -177.674 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.21 145.69 36.4 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.85 1.426 . . . . 0.0 114.85 -170.046 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -125.91 162.89 24.16 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.739 2.015 . . . . 0.0 112.067 -176.259 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -106.31 141.48 37.57 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.938 1.295 . . . . 0.0 112.375 -172.406 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 52.5 tp -115.41 131.58 56.89 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 126.332 1.853 . . . . 0.0 109.114 169.656 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 62.3 ttm-85 -124.07 123.48 40.42 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.794 1.638 . . . . 0.0 110.367 177.638 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 40.0 t -107.8 114.02 45.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 125.037 1.335 . . . . 0.0 109.272 172.676 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 73.0 p -95.11 152.2 18.55 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.509 1.524 . . . . 0.0 110.705 178.142 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -60.02 144.54 49.08 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.617 0.767 . . . . 0.0 112.679 -176.698 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 31.7 tpt85 -74.99 109.25 8.3 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 124.269 1.028 . . . . 0.0 109.239 175.624 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 84.0 mtp180 -74.34 160.45 31.04 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.684 0.794 . . . . 0.0 110.216 172.948 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -67.81 119.66 12.87 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.474 0.71 . . . . 0.0 111.497 178.767 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 . . . . . 0 C--O 1.251 1.17 0 C-N-CA 127.414 2.286 . . . . 0.0 111.178 -176.837 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.488 1.474 0 CA-C-O 115.972 -1.965 . . . . 0.0 113.459 . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -55.7 141.14 84.66 Favored 'Trans proline' 0 C--N 1.359 1.111 0 CA-C-N 123.223 2.187 . . . . 0.0 112.817 -174.915 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.2 117.17 4.88 Favored 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 122.982 2.455 . . . . 0.0 111.993 -170.919 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.9 t -179.09 159.28 0.97 Allowed 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 127.216 2.206 . . . . 0.0 111.211 -178.162 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -125.03 133.64 52.87 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.803 1.641 . . . . 0.0 110.121 -178.538 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 93.6 p -140.96 155.19 68.95 Favored Pre-proline 0 CA--C 1.551 0.981 0 N-CA-C 114.511 1.3 . . . . 0.0 114.511 -176.756 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -68.96 162.03 82.66 Favored 'Cis proline' 0 C--N 1.353 0.766 0 CA-C-N 119.101 0.715 . . . . 0.0 111.511 -7.422 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.33 -32.61 70.24 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 122.803 0.441 . . . . 0.0 112.169 173.119 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 50.1 tp -140.23 120.41 13.81 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 125.452 1.501 . . . . 0.0 109.294 171.175 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 55.8 tp -100.6 125.89 47.02 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.439 1.496 . . . . 0.0 109.003 170.104 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.8 t -108.82 125.64 65.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 171.203 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 27.7 m -128.69 163.4 33.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 124.775 1.23 . . . . 0.0 110.83 173.014 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 52.7 m -88.21 146.95 25.1 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.592 0.757 . . . . 0.0 110.097 169.911 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -54.36 123.04 11.73 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.289 1.436 . . . . 0.0 111.074 174.822 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.08 3.52 72.97 Favored Glycine 0 CA--C 1.532 1.111 0 C-N-CA 125.863 1.697 . . . . 0.0 114.9 -174.733 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -90.26 157.02 17.88 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 119.612 1.706 . . . . 0.0 111.376 169.214 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -85.49 119.77 26.21 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.763 0.825 . . . . 0.0 109.957 174.628 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -98.84 129.62 45.23 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.466 1.107 . . . . 0.0 110.752 -179.246 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 89.9 m -132.73 131.46 41.24 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 119.352 0.978 . . . . 0.0 111.692 177.392 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -102.93 155.93 18.02 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.381 1.873 . . . . 0.0 111.089 172.52 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.6 m -98.68 136.03 39.32 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 125.402 1.481 . . . . 0.0 107.887 168.874 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 35.7 t -138.1 124.68 20.83 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 124.639 1.176 . . . . 0.0 110.308 -179.704 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 75.6 m -116.14 143.89 44.88 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 124.228 1.011 . . . . 0.0 111.094 -173.219 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -141.23 152.98 45.02 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 125.185 1.394 . . . . 0.0 113.694 170.026 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.1 t -132.83 143.37 49.49 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 166.435 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -146.85 145.36 29.83 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.528 0.731 . . . . 0.0 112.43 -168.208 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 24.4 p -86.84 -16.96 34.56 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.475 1.51 . . . . 0.0 113.529 -177.279 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 74.6 m -88.43 160.3 17.61 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.54 1.136 . . . . 0.0 111.629 173.5 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -69.91 -16.13 63.18 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.027 1.331 . . . . 0.0 114.107 -177.155 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.5 t -161.73 157.54 24.5 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.466 1.507 . . . . 0.0 111.027 177.597 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 53.9 p90 -155.83 153.6 30.02 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.126 1.37 . . . . 0.0 111.946 -177.299 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.6 t -95.98 128.24 47.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 171.466 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -112.77 118.67 35.61 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 125.379 1.471 . . . . 0.0 108.687 -177.123 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -116.48 155.24 28.96 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.921 1.688 . . . . 0.0 111.636 -169.438 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 13.6 t90 -124.32 138.57 54.37 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.726 1.211 . . . . 0.0 112.29 179.941 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 53.7 m-85 -136.65 145.61 45.01 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.031 1.333 . . . . 0.0 113.528 -174.973 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 78.9 ttt-85 -106.42 142.0 36.8 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.683 1.593 . . . . 0.0 108.414 167.833 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 37.1 mtp -86.73 145.37 26.69 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 119.034 0.833 . . . . 0.0 112.624 177.864 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.6 m -92.41 159.13 37.57 Favored Pre-proline 0 CA--C 1.547 0.86 0 C-N-CA 125.056 1.342 . . . . 0.0 111.999 175.755 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -57.79 -25.73 70.23 Favored 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 124.102 3.201 . . . . 0.0 114.224 174.412 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 33.5 p -77.06 -0.56 25.11 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.474 1.91 . . . . 0.0 114.017 174.943 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 71.16 20.87 4.99 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 127.178 2.191 . . . . 0.0 112.442 -173.111 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 20.5 mm100 -88.3 -172.67 3.88 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.033 0.933 . . . . 0.0 110.083 168.99 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.7 p -141.35 150.1 42.0 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.761 1.624 . . . . 0.0 110.628 -175.817 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -128.15 132.26 48.91 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.786 1.234 . . . . 0.0 111.032 176.909 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 57.0 tttt -79.76 132.47 36.17 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.372 0.669 . . . . 0.0 111.644 -176.639 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 67.9 mt -106.88 -46.09 4.03 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.077 1.351 . . . . 0.0 112.487 -169.921 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -174.15 175.95 2.61 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 127.175 2.19 . . . . 0.0 110.089 -174.478 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.63 167.7 27.83 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.888 1.275 . . . . 0.0 112.318 -179.363 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -129.33 144.0 51.06 Favored Pre-proline 0 CA--C 1.549 0.909 0 C-N-CA 126.181 1.792 . . . . 0.0 110.226 169.808 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_exo -58.03 -42.06 0.32 Allowed 'Cis proline' 0 C--N 1.356 0.969 0 N-CA-C 116.352 1.635 . . . . 0.0 116.352 2.755 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -145.43 152.94 40.61 Favored 'General case' 0 C--N 1.313 -0.998 0 C-N-CA 129.097 2.959 . . . . 0.0 113.048 177.292 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -96.11 4.81 52.24 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.488 1.515 . . . . 0.0 114.249 175.916 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 77.3 mtp85 -61.19 -11.13 8.03 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 115.66 1.726 . . . . 0.0 115.66 -169.388 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 47.2 p -71.67 -20.37 61.95 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.641 1.176 . . . . 0.0 113.918 172.297 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -135.82 168.55 16.84 Favored Pre-proline 0 CA--C 1.548 0.9 0 C-N-CA 125.761 1.625 . . . . 0.0 111.542 -176.498 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -59.55 138.48 83.96 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 123.264 2.642 . . . . 0.0 111.889 169.626 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -97.35 -27.0 9.56 Favored Glycine 0 N--CA 1.471 1.015 0 C-N-CA 124.914 1.245 . . . . 0.0 111.762 177.606 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 70.11 -40.62 0.47 Allowed 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 129.812 3.245 . . . . 0.0 116.069 167.5 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -142.95 131.13 21.93 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.427 1.891 . . . . 0.0 111.021 176.868 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 14.7 m -71.96 -3.84 24.99 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.433 1.093 . . . . 0.0 113.607 176.662 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 46.5 mtp85 -66.78 -28.09 68.11 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.649 1.579 . . . . 0.0 113.703 -175.572 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 -101.43 142.32 32.99 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.139 1.775 . . . . 0.0 112.013 -172.673 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 65.3 ttt180 -143.48 144.36 31.96 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.63 1.572 . . . . 0.0 111.27 178.475 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 57.6 t -120.34 132.56 69.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 125.663 1.585 . . . . 0.0 109.08 169.707 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 25.0 m -126.66 133.79 50.89 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.922 1.289 . . . . 0.0 109.858 177.11 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -84.86 138.38 32.58 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.398 0.679 . . . . 0.0 110.67 172.481 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 41.5 mt -85.07 159.61 56.65 Favored Pre-proline 0 CA--C 1.544 0.717 0 C-N-CA 124.863 1.265 . . . . 0.0 111.771 179.247 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -63.03 -5.91 8.61 Favored 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 123.675 2.917 . . . . 0.0 113.95 174.012 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 23.2 m120 -60.93 -25.22 66.62 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.191 0.996 . . . . 0.0 112.852 169.251 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 89.23 -16.51 55.67 Favored Glycine 0 N--CA 1.476 1.308 0 C-N-CA 125.53 1.538 . . . . 0.0 114.768 174.427 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.6 ptp180 -154.57 73.69 0.91 Allowed 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 126.198 1.799 . . . . 0.0 109.487 169.816 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -173.73 148.67 1.5 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 128.378 2.671 . . . . 0.0 108.55 -178.642 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -146.66 153.48 40.35 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.796 1.035 . . . . 0.0 113.796 -166.844 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -116.33 141.75 47.75 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.887 1.675 . . . . 0.0 110.065 168.115 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 42.5 mtt -130.73 115.29 16.45 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 124.629 1.172 . . . . 0.0 110.546 -173.924 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 43.7 m -116.02 134.03 55.39 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.36 1.245 . . . . 0.0 114.36 -167.749 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 17.1 t -104.56 113.72 42.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 126.569 1.948 . . . . 0.0 106.825 167.865 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 4.0 p -77.48 133.61 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 122.513 0.325 . . . . 0.0 110.755 -179.911 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 45.92 64.11 1.59 Allowed 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 125.491 1.516 . . . . 0.0 112.08 174.12 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.02 144.41 57.3 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.368 1.067 . . . . 0.0 112.994 -169.694 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 54.3 mtp85 -114.87 158.33 22.1 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 126.598 1.959 . . . . 0.0 110.036 -176.393 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 91.0 mtm-85 -53.6 -32.62 51.87 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 -178.833 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -70.84 -18.82 62.7 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 115.676 1.732 . . . . 0.0 115.676 176.613 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -73.2 -25.55 60.81 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 119.566 1.076 . . . . 0.0 112.045 178.769 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 14.8 m -51.35 139.44 19.32 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.979 1.312 . . . . 0.0 112.905 178.923 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 152.09 -166.6 31.04 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 124.338 0.971 . . . . 0.0 113.023 -175.777 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.5 m -92.36 143.88 25.94 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.9 1.28 . . . . 0.0 110.167 -179.617 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -138.39 156.55 47.49 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.931 1.692 . . . . 0.0 111.719 -177.606 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -163.06 157.09 20.34 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.06 1.344 . . . . 0.0 112.4 177.527 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 5.6 m -100.51 162.98 12.57 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.997 0.919 . . . . 0.0 111.85 172.724 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -145.21 130.19 3.76 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 124.392 0.996 . . . . 0.0 112.163 169.437 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -111.65 145.0 40.0 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 118.41 1.105 . . . . 0.0 112.327 178.437 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.4 tt -141.34 133.58 29.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.236 1.414 . . . . 0.0 110.125 179.405 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 53.2 p -71.48 161.62 30.74 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 -176.594 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -58.44 -15.49 11.09 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 115.372 1.619 . . . . 0.0 115.372 177.399 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -70.56 136.6 85.96 Favored Pre-proline 0 CA--C 1.552 1.027 0 C-N-CA 125.047 1.339 . . . . 0.0 112.244 -178.359 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_exo -57.07 -27.89 76.12 Favored 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 123.426 2.751 . . . . 0.0 114.066 172.631 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 14.5 tppt? -84.4 1.73 43.94 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 125.395 1.478 . . . . 0.0 113.997 -177.916 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -67.11 161.41 24.64 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -172.959 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 28.0 mp0 -128.09 159.15 35.99 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.794 2.037 . . . . 0.0 108.983 170.72 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 42.4 mt -82.83 120.44 34.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 123.509 0.723 . . . . 0.0 110.597 178.868 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 15.3 ptpt -90.99 143.76 26.38 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.421 1.089 . . . . 0.0 111.241 168.648 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -140.07 158.79 43.5 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 126.255 1.822 . . . . 0.0 110.351 -173.222 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 6.2 t -136.74 -166.67 1.94 Allowed 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.269 1.028 . . . . 0.0 112.871 -179.985 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 96.4 mt -62.7 124.77 21.86 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.268 1.827 . . . . 0.0 112.423 -170.371 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 73.6 mtm-85 -62.23 151.36 36.45 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.817 1.647 . . . . 0.0 113.507 -173.965 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.89 166.26 12.17 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.668 1.987 . . . . 0.0 110.846 173.33 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -133.85 146.24 50.42 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.422 1.089 . . . . 0.0 111.996 178.727 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 59.5 tp -113.86 137.11 52.12 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 126.182 1.793 . . . . 0.0 110.201 173.051 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 61.9 ttm-85 -127.81 120.18 27.28 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 125.522 1.529 . . . . 0.0 109.699 169.412 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 43.5 t -104.32 113.35 41.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 124.786 1.234 . . . . 0.0 108.742 173.144 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 53.8 p -95.05 140.88 29.38 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.349 1.459 . . . . 0.0 110.039 -178.697 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 4.2 pm0 -61.96 144.32 55.24 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.729 0.812 . . . . 0.0 112.855 -172.406 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 45.3 ttt85 -77.66 98.32 5.42 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.049 0.939 . . . . 0.0 110.837 -170.399 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.41 162.13 27.46 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.93 1.292 . . . . 0.0 113.117 -177.245 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -70.53 154.31 42.01 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.44 1.096 . . . . 0.0 112.419 175.22 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 . . . . . 0 C--O 1.253 1.276 0 C-N-CA 125.079 1.352 . . . . 0.0 113.274 177.682 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 47.5 ttp . . . . . 0 N--CA 1.488 1.472 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.233 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -72.02 168.53 23.73 Favored 'Trans proline' 0 CA--C 1.543 0.943 0 C-N-CA 123.339 2.693 . . . . 0.0 111.104 172.459 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -55.01 126.24 21.92 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.963 2.442 . . . . 0.0 111.745 172.11 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 86.7 m -140.91 148.63 40.75 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.252 1.021 . . . . 0.0 110.944 -169.809 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -114.11 124.32 51.8 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.97 2.108 . . . . 0.0 108.11 169.318 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 88.0 p -140.75 156.09 69.05 Favored Pre-proline 0 CA--C 1.549 0.916 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -169.156 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -66.68 161.18 75.84 Favored 'Cis proline' 0 C--N 1.355 0.894 0 CA-C-N 119.84 0.979 . . . . 0.0 112.111 -2.457 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.81 -27.5 66.65 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 177.75 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 49.1 tp -141.15 122.54 14.93 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.365 1.466 . . . . 0.0 108.749 169.835 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 59.5 tp -106.16 126.06 51.75 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.157 1.383 . . . . 0.0 109.057 170.869 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.3 t -109.68 124.43 66.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 123.864 0.866 . . . . 0.0 108.798 172.998 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 33.7 m -128.66 172.43 15.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 C-N-CA 124.919 1.287 . . . . 0.0 110.951 171.43 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 66.2 m -104.48 151.92 22.98 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.516 1.526 . . . . 0.0 110.313 170.971 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -44.29 124.63 4.12 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.313 1.445 . . . . 0.0 112.967 172.357 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 89.99 -2.37 81.68 Favored Glycine 0 CA--C 1.531 1.048 0 C-N-CA 125.732 1.634 . . . . 0.0 114.484 -179.261 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -89.31 153.82 20.58 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.699 1.75 . . . . 0.0 111.909 174.367 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -80.81 118.25 22.17 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.588 0.755 . . . . 0.0 110.355 174.806 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -97.32 114.26 26.02 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.074 0.95 . . . . 0.0 110.533 178.978 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 46.9 m -122.35 124.19 43.13 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.936 0.895 . . . . 0.0 111.4 -175.288 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -102.45 158.16 16.41 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 126.646 1.978 . . . . 0.0 110.742 171.683 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 86.1 m -101.63 135.05 43.8 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.13 1.372 . . . . 0.0 109.551 169.861 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 42.7 t -113.7 132.79 55.67 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.611 1.564 . . . . 0.0 110.691 169.631 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 67.3 m -126.55 122.13 34.24 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.948 0.899 . . . . 0.0 110.852 179.574 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 24.8 m-85 -134.26 156.13 48.96 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 126.701 2.0 . . . . 0.0 110.682 169.515 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 64.1 p -133.92 143.23 48.1 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.665 1.186 . . . . 0.0 110.594 169.336 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -147.07 144.08 28.82 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.058 1.343 . . . . 0.0 111.21 -176.779 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 23.1 p -70.93 -26.28 63.13 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.378 1.471 . . . . 0.0 112.281 172.048 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 11.3 m -53.06 138.89 29.74 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 126.841 2.056 . . . . 0.0 111.93 170.016 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -63.12 -31.21 72.3 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.658 1.183 . . . . 0.0 112.034 178.409 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.6 m -157.73 159.79 37.21 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 126.201 1.8 . . . . 0.0 110.921 175.003 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 52.1 p90 -160.06 162.22 34.11 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.731 1.612 . . . . 0.0 110.774 -173.409 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 58.2 t -95.94 129.35 46.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 C-N-CA 124.503 1.121 . . . . 0.0 108.24 175.29 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 19.4 tp -107.59 139.72 41.7 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.417 1.087 . . . . 0.0 109.923 172.592 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 13.6 m-80 -132.78 149.84 52.23 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.524 1.529 . . . . 0.0 111.107 -168.997 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 18.3 t90 -121.73 137.89 54.58 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.035 1.334 . . . . 0.0 111.617 -179.055 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -137.43 145.33 43.03 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 -172.836 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -102.03 139.76 37.22 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.021 1.328 . . . . 0.0 108.274 167.01 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 32.8 mtp -84.26 142.75 30.02 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.107 0.867 . . . . 0.0 112.11 176.862 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 45.6 m -91.17 158.4 41.41 Favored Pre-proline 0 CA--C 1.548 0.883 0 C-N-CA 124.843 1.257 . . . . 0.0 111.68 174.867 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -55.43 -33.45 85.89 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 123.947 3.098 . . . . 0.0 114.346 177.245 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.3 m -76.99 6.31 6.52 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.904 1.282 . . . . 0.0 113.895 177.374 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 74.02 20.93 2.69 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 127.208 2.203 . . . . 0.0 112.895 -178.188 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 20.7 mm100 -88.63 -172.89 3.92 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.185 0.994 . . . . 0.0 110.258 169.658 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.6 p -145.48 142.69 29.47 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.663 1.585 . . . . 0.0 110.323 -174.805 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -119.93 130.55 54.85 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 124.578 1.151 . . . . 0.0 111.17 175.493 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -77.97 125.75 29.81 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.364 1.065 . . . . 0.0 111.089 -177.12 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 55.7 mt -99.81 -49.31 4.4 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 125.172 1.389 . . . . 0.0 111.278 -172.658 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -162.6 173.16 14.3 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.249 1.819 . . . . 0.0 110.479 -178.006 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.18 163.34 36.11 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.074 1.35 . . . . 0.0 111.733 -178.215 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -145.62 124.08 6.52 Favored Pre-proline 0 CA--C 1.546 0.825 0 C-N-CA 124.833 1.253 . . . . 0.0 110.676 172.229 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.39 158.43 19.09 Favored 'Cis proline' 0 CA--C 1.538 0.681 0 CA-C-N 119.48 0.85 . . . . 0.0 112.761 -12.949 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -75.53 94.77 3.2 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 121.845 0.831 . . . . 0.0 110.591 179.176 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -91.56 -3.55 56.34 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.006 1.722 . . . . 0.0 114.548 -174.042 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 57.2 mtp180 -73.8 -54.81 7.19 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.69 1.196 . . . . 0.0 113.22 -168.703 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 34.4 m 61.09 10.9 3.12 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 126.039 1.736 . . . . 0.0 114.124 -176.134 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -135.82 164.85 40.37 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 127.668 2.387 . . . . 0.0 110.262 -171.302 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -67.99 169.64 16.02 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 123.352 2.702 . . . . 0.0 112.119 174.094 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 113.88 -1.68 24.39 Favored Glycine 0 CA--C 1.535 1.298 0 C-N-CA 124.941 1.258 . . . . 0.0 114.064 -171.747 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -97.48 157.43 16.01 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.21 1.404 . . . . 0.0 109.975 168.649 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -141.6 153.6 44.89 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.454 1.501 . . . . 0.0 110.173 172.984 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 54.4 p -63.68 -15.92 59.65 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.197 0.999 . . . . 0.0 113.405 175.009 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 41.6 mmm-85 -71.43 -16.71 62.39 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.276 1.43 . . . . 0.0 113.091 173.786 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 -108.05 135.3 49.64 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.789 1.236 . . . . 0.0 111.046 177.82 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 49.7 ttp180 -138.11 136.95 37.23 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.679 1.591 . . . . 0.0 110.609 -176.242 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 87.3 t -126.43 130.25 71.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 C-N-CA 125.633 1.573 . . . . 0.0 109.157 175.579 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 87.1 m -130.58 130.34 43.92 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.117 1.367 . . . . 0.0 110.281 -176.363 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -82.87 133.97 35.11 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.16 0.984 . . . . 0.0 110.195 173.652 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 28.4 mt -86.63 160.33 50.67 Favored Pre-proline 0 CA--C 1.543 0.697 0 C-N-CA 123.587 0.755 . . . . 0.0 111.339 176.659 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -62.49 -8.23 12.44 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 123.374 2.716 . . . . 0.0 114.187 174.75 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -65.77 -22.34 66.57 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-N 119.207 0.912 . . . . 0.0 112.602 169.271 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 80.66 -34.33 2.3 Favored Glycine 0 N--CA 1.473 1.167 0 C-N-CA 128.232 2.825 . . . . 0.0 113.914 175.871 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? -122.62 73.64 1.14 Allowed 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.743 1.617 . . . . 0.0 108.663 168.191 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -177.64 140.82 0.27 Allowed 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 128.495 2.718 . . . . 0.0 108.432 176.651 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -143.64 153.26 42.33 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 -168.666 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 21.4 m170 -108.67 131.72 54.63 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.341 1.456 . . . . 0.0 110.845 168.556 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -113.95 120.25 40.03 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 126.612 1.965 . . . . 0.0 108.157 176.691 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.2 t -128.31 127.17 42.22 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -168.383 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 47.8 t -91.17 116.39 32.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 125.441 1.496 . . . . 0.0 107.08 169.117 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 61.0 t -83.96 120.26 34.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 124.637 1.175 . . . . 0.0 109.638 -175.784 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 52.15 65.73 1.42 Allowed 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.228 1.811 . . . . 0.0 111.567 179.167 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.66 147.59 51.65 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.717 1.207 . . . . 0.0 112.628 -171.507 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 54.7 mmm-85 -122.72 165.31 16.75 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.971 1.709 . . . . 0.0 110.578 178.475 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 34.9 mtp180 -55.11 -33.88 63.21 Favored 'General case' 0 N--CA 1.483 1.217 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 -173.15 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -62.12 -18.54 61.13 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 125.241 1.417 . . . . 0.0 114.637 175.28 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 -81.21 -12.65 59.11 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 119.582 1.083 . . . . 0.0 113.316 176.903 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 20.9 m -62.64 138.63 58.54 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 119.517 1.053 . . . . 0.0 112.438 -179.486 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 154.74 -166.93 32.53 Favored Glycine 0 N--CA 1.473 1.124 0 O-C-N 121.377 -0.827 . . . . 0.0 113.611 -177.033 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 6.4 m -93.9 144.35 25.52 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.334 1.054 . . . . 0.0 110.366 -178.844 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 68.9 m-85 -142.96 155.51 44.7 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.354 1.461 . . . . 0.0 111.681 -177.989 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.4 pp -153.5 173.43 15.71 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.37 1.068 . . . . 0.0 112.593 177.933 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 28.1 t -125.6 156.13 39.63 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.813 1.645 . . . . 0.0 110.316 -176.209 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -152.74 137.02 5.64 Favored Glycine 0 N--CA 1.47 0.931 0 O-C-N 121.197 -0.939 . . . . 0.0 114.677 -179.188 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -110.02 152.1 26.34 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.736 1.214 . . . . 0.0 112.721 -179.506 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.5 tt -152.13 135.44 7.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 125.55 1.54 . . . . 0.0 110.442 173.634 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 33.7 m -67.04 159.65 28.26 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.775 0.83 . . . . 0.0 112.91 179.452 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 2.3 pp -72.05 -7.93 51.68 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 115.406 1.632 . . . . 0.0 115.406 -176.861 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -80.8 148.59 65.46 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 124.71 1.204 . . . . 0.0 112.082 177.156 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -68.66 -19.79 41.37 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 123.245 2.63 . . . . 0.0 113.355 -179.924 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -77.37 -9.56 58.92 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.798 1.239 . . . . 0.0 113.665 177.12 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.86 162.85 20.77 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.004 1.322 . . . . 0.0 113.785 -175.765 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -138.21 154.72 49.1 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.011 1.724 . . . . 0.0 109.368 175.857 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 45.8 mt -79.27 126.66 39.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 123.345 0.658 . . . . 0.0 110.838 -175.687 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -102.6 129.09 49.06 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.223 1.409 . . . . 0.0 109.38 169.375 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -104.11 149.42 25.24 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.742 1.217 . . . . 0.0 111.842 -174.386 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 88.1 p -91.62 170.03 10.26 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.661 1.356 . . . . 0.0 114.661 178.81 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 87.8 mt -68.27 127.77 34.13 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.033 0.933 . . . . 0.0 109.471 168.809 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.1 166.88 20.47 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 115.236 1.569 . . . . 0.0 115.236 -169.602 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -126.35 168.78 13.69 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.842 2.057 . . . . 0.0 111.234 169.574 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -120.57 142.16 49.62 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.301 1.44 . . . . 0.0 110.89 173.007 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 51.4 tp -110.16 131.24 55.23 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 126.082 1.753 . . . . 0.0 109.791 171.852 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -121.78 117.66 27.11 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.674 1.59 . . . . 0.0 109.395 169.955 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 39.5 t -104.18 111.84 35.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 C-N-CA 124.225 1.01 . . . . 0.0 108.665 170.949 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 71.8 p -86.69 151.3 23.53 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 126.087 1.755 . . . . 0.0 110.28 179.564 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -63.09 149.29 45.52 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.811 0.844 . . . . 0.0 112.805 -175.142 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 56.8 ttp180 -59.92 117.1 4.64 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 124.517 1.127 . . . . 0.0 109.697 -174.21 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 77.7 mtm-85 -70.61 152.67 43.65 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 -168.096 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -70.09 154.24 42.17 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.546 1.139 . . . . 0.0 112.447 175.053 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 . . . . . 0 C--O 1.254 1.293 0 C-N-CA 125.011 1.324 . . . . 0.0 114.451 176.921 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 75.0 mtm . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 116.506 -1.712 . . . . 0.0 111.875 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -71.19 160.92 47.54 Favored 'Trans proline' 0 CA--C 1.545 1.048 0 C-N-CA 122.438 2.092 . . . . 0.0 111.665 176.243 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -69.39 133.6 26.64 Favored 'Trans proline' 0 CA--C 1.537 0.655 0 C-N-CA 123.375 2.717 . . . . 0.0 111.322 176.276 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 37.3 p -153.11 151.61 30.37 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 125.436 1.494 . . . . 0.0 111.916 -172.452 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -121.93 134.39 54.84 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.382 1.473 . . . . 0.0 109.912 173.936 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.9 m -140.85 156.39 68.73 Favored Pre-proline 0 N--CA 1.479 1.016 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 179.523 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -70.17 158.16 92.51 Favored 'Cis proline' 0 C--N 1.352 0.733 0 CA-C-N 119.494 0.855 . . . . 0.0 110.926 -8.646 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -56.96 -32.01 65.6 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 172.715 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 49.2 tp -139.13 121.17 15.66 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.351 1.46 . . . . 0.0 109.322 170.031 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 49.4 tp -102.19 126.93 49.3 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.351 1.46 . . . . 0.0 109.205 171.019 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.6 t -110.75 124.64 67.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 124.081 0.952 . . . . 0.0 108.454 172.011 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 36.0 m -127.52 168.83 19.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 124.618 1.167 . . . . 0.0 111.677 174.174 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 44.0 m -94.54 146.41 24.12 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.869 1.267 . . . . 0.0 110.151 170.915 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -57.13 117.65 4.24 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.474 1.51 . . . . 0.0 111.867 -178.973 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 100.26 -2.9 56.53 Favored Glycine 0 CA--C 1.534 1.268 0 C-N-CA 125.919 1.723 . . . . 0.0 114.58 -175.937 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -86.21 157.27 20.01 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.232 1.516 . . . . 0.0 112.286 173.988 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -83.25 113.48 20.71 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.006 0.923 . . . . 0.0 110.44 175.773 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -95.82 116.63 29.19 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.101 0.961 . . . . 0.0 110.837 -178.754 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 36.1 m -121.5 127.49 51.09 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.763 0.825 . . . . 0.0 111.558 -177.014 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -100.66 150.42 22.75 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.07 1.748 . . . . 0.0 110.896 170.625 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 27.3 m -93.15 137.88 32.08 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 125.917 1.687 . . . . 0.0 108.179 169.337 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 42.9 t -143.88 131.19 20.85 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.9 1.28 . . . . 0.0 110.37 -176.356 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.9 t -128.27 136.09 50.54 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 121.321 -0.862 . . . . 0.0 112.058 -169.663 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -145.48 156.21 43.58 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.786 1.634 . . . . 0.0 113.464 174.504 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.2 t -148.42 139.06 22.83 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.898 1.679 . . . . 0.0 108.348 168.184 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -141.03 147.53 38.79 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.277 1.031 . . . . 0.0 112.314 -171.988 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 7.7 p -79.0 68.59 4.98 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 126.868 2.067 . . . . 0.0 110.697 176.424 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.1 t -156.87 165.07 37.24 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.319 1.448 . . . . 0.0 111.618 -173.211 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -74.6 -20.91 59.74 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.135 0.974 . . . . 0.0 112.303 169.95 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.6 m -171.59 163.11 6.61 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.955 2.102 . . . . 0.0 112.146 178.503 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 54.4 p90 -147.31 154.71 41.28 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.594 1.158 . . . . 0.0 111.787 176.154 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.4 t -95.95 129.39 46.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 125.204 1.402 . . . . 0.0 107.275 172.927 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 57.8 tp -99.39 134.72 41.85 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 124.167 0.987 . . . . 0.0 109.528 173.984 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 -127.84 155.39 44.2 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.107 1.363 . . . . 0.0 110.641 -177.922 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 10.1 t90 -125.36 137.3 54.03 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.634 1.174 . . . . 0.0 111.628 178.868 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -132.81 150.93 52.11 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.228 1.411 . . . . 0.0 113.347 -176.392 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -112.73 141.5 46.45 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.794 1.638 . . . . 0.0 109.178 168.992 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 81.2 mmm -74.19 133.39 42.73 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.057 0.543 . . . . 0.0 111.34 173.755 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 50.0 m -86.04 157.52 56.85 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 124.65 1.18 . . . . 0.0 111.783 172.807 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -57.57 -28.25 80.34 Favored 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 123.905 3.07 . . . . 0.0 114.284 174.97 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 25.2 p -77.03 3.81 11.51 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 126.022 1.729 . . . . 0.0 114.033 174.868 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 67.53 20.96 9.65 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 127.308 2.243 . . . . 0.0 112.932 -174.021 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -90.13 -172.65 3.56 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.958 1.303 . . . . 0.0 109.925 169.045 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.0 p -138.98 145.65 39.97 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.025 1.33 . . . . 0.0 110.347 -177.717 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -122.67 134.56 54.48 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 123.775 0.83 . . . . 0.0 111.569 173.154 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -75.23 137.52 41.3 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.96 0.904 . . . . 0.0 111.174 179.406 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 52.0 mt -114.55 -39.78 3.73 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.384 1.474 . . . . 0.0 112.865 -169.916 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -171.7 175.29 4.03 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.619 1.968 . . . . 0.0 110.175 -176.126 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -157.06 167.72 29.61 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.936 1.294 . . . . 0.0 112.096 179.844 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -145.23 115.44 4.99 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 125.76 1.624 . . . . 0.0 109.378 169.345 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_exo -53.44 148.7 15.41 Favored 'Cis proline' 0 C--N 1.352 0.713 0 CA-C-N 120.22 1.114 . . . . 0.0 113.546 -5.573 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -67.08 152.78 45.14 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 -170.221 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.1 t0 -142.93 140.55 31.18 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.597 1.559 . . . . 0.0 111.714 -172.363 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.4 mmm180 -101.73 -77.62 0.55 Allowed 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.777 1.231 . . . . 0.0 111.031 173.163 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 41.1 m 59.36 -58.56 0.05 Allowed 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 128.616 2.766 . . . . 0.0 117.639 169.815 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -135.87 157.06 76.75 Favored Pre-proline 0 CA--C 1.544 0.74 0 C-N-CA 126.391 1.876 . . . . 0.0 112.25 -170.68 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -61.45 147.73 94.73 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 122.765 2.31 . . . . 0.0 110.099 166.779 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 104.09 -17.15 48.92 Favored Glycine 0 N--CA 1.47 0.931 0 C-N-CA 124.357 0.98 . . . . 0.0 112.989 -179.823 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -83.55 62.94 7.1 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 118.13 0.965 . . . . 0.0 110.255 168.963 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -70.51 154.15 42.17 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.494 1.518 . . . . 0.0 112.859 -178.897 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 26.8 t -59.68 -23.07 62.79 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.001 1.32 . . . . 0.0 113.784 -177.16 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 30.4 ptt-85 -68.43 -23.0 64.57 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 113.893 1.072 . . . . 0.0 113.893 178.597 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 84.6 m-85 -93.83 123.41 37.16 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.488 1.115 . . . . 0.0 110.013 176.078 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -139.02 144.68 38.98 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.146 0.978 . . . . 0.0 111.645 -175.267 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 57.5 t -126.55 126.73 69.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 125.36 1.464 . . . . 0.0 109.379 -179.428 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 86.4 m -130.53 137.75 49.87 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.876 1.271 . . . . 0.0 110.421 -176.109 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -82.17 141.93 32.63 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.358 0.599 . . . . 0.0 112.459 172.249 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 39.2 mt -77.9 161.05 72.67 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 123.419 0.687 . . . . 0.0 110.898 169.37 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -68.37 -4.16 12.32 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 123.435 2.757 . . . . 0.0 113.562 171.699 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.81 -23.05 65.98 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 124.33 1.052 . . . . 0.0 112.494 172.005 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 93.66 -18.43 56.52 Favored Glycine 0 N--CA 1.477 1.428 0 C-N-CA 125.646 1.593 . . . . 0.0 114.715 170.695 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 27.1 ptt180 -154.59 73.66 0.91 Allowed 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 126.085 1.754 . . . . 0.0 109.204 170.08 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -173.8 147.53 1.36 Allowed 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 128.308 2.643 . . . . 0.0 108.462 -178.461 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 25.0 m-85 -146.86 157.08 43.56 Favored 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 113.958 1.096 . . . . 0.0 113.958 -166.383 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -116.55 143.09 46.04 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.193 1.797 . . . . 0.0 110.744 169.014 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 39.8 mtt -126.85 120.64 29.74 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.975 1.31 . . . . 0.0 109.95 177.615 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 69.0 m -120.42 128.21 52.98 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 114.263 1.208 . . . . 0.0 114.263 -168.041 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 21.6 t -94.6 98.88 8.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 N-CA-C 105.958 -1.868 . . . . 0.0 105.958 167.017 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 92.8 t -70.5 125.43 28.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.597 1.159 . . . . 0.0 109.182 -179.035 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 75.8 ttt180 52.35 65.59 1.46 Allowed 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.21 1.404 . . . . 0.0 110.929 179.181 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.26 130.57 43.29 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 121.327 -0.858 . . . . 0.0 111.721 -172.281 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 8.1 mpt_? -95.3 161.83 13.93 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.594 1.558 . . . . 0.0 110.086 175.266 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 89.8 mtm-85 -53.4 -36.92 61.98 Favored 'General case' 0 N--CA 1.482 1.141 0 O-C-N 121.151 -0.968 . . . . 0.0 112.708 179.732 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -62.35 -16.03 51.94 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.045 1.738 . . . . 0.0 114.845 176.264 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -80.53 -11.16 59.7 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 119.958 1.254 . . . . 0.0 113.272 176.234 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 21.2 m -63.91 132.23 50.12 Favored 'General case' 0 N--CA 1.477 0.878 0 O-C-N 120.534 -1.354 . . . . 0.0 112.586 -179.803 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 158.96 -167.32 34.79 Favored Glycine 0 N--CA 1.472 1.042 0 O-C-N 121.162 -0.961 . . . . 0.0 113.725 -177.68 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.2 m -93.4 138.31 31.86 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.888 1.275 . . . . 0.0 110.721 -178.045 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -135.9 156.46 48.73 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.804 1.641 . . . . 0.0 112.556 -177.647 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -160.25 148.62 16.82 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.808 1.243 . . . . 0.0 112.332 179.184 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 4.5 m -89.13 170.49 10.57 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.293 0.568 . . . . 0.0 111.999 172.49 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -155.04 115.6 0.67 Allowed Glycine 0 CA--C 1.526 0.765 0 C-N-CA 124.532 1.063 . . . . 0.0 111.673 168.435 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -87.82 156.26 19.48 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 117.791 0.795 . . . . 0.0 111.638 172.458 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 17.8 tt -154.43 130.19 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 124.602 1.161 . . . . 0.0 110.791 174.297 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 22.8 m -67.92 159.28 30.85 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.648 1.179 . . . . 0.0 113.402 -178.25 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.81 -9.91 48.34 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 115.578 1.696 . . . . 0.0 115.578 179.012 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -75.05 142.93 76.65 Favored Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 124.335 1.054 . . . . 0.0 112.265 -179.142 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_exo -56.14 -27.75 66.96 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 123.607 2.871 . . . . 0.0 114.658 174.736 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -84.51 0.98 47.78 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.819 1.248 . . . . 0.0 114.309 -179.49 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.88 164.52 17.26 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 124.4 1.08 . . . . 0.0 113.683 -177.213 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -146.1 152.44 39.31 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.76 1.624 . . . . 0.0 109.424 178.681 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 64.9 mt -71.46 123.37 25.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 124.28 1.032 . . . . 0.0 111.023 -174.774 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -83.72 88.38 7.07 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.451 1.501 . . . . 0.0 110.742 178.268 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -74.86 152.86 38.88 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.882 0.873 . . . . 0.0 110.566 171.353 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 58.8 m -157.35 -177.39 6.56 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.104 1.362 . . . . 0.0 112.24 179.528 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.5 tt -55.65 106.96 0.29 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.316 1.846 . . . . 0.0 113.083 -170.627 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.33 156.52 15.54 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.8 1.64 . . . . 0.0 114.762 -175.538 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -118.77 169.65 9.66 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 126.865 2.066 . . . . 0.0 111.558 177.559 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -130.82 144.94 51.81 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.844 1.257 . . . . 0.0 111.821 179.605 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 55.1 tp -115.21 134.8 54.81 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 126.417 1.887 . . . . 0.0 110.178 173.771 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 60.0 ttt85 -125.9 120.62 30.89 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.791 1.636 . . . . 0.0 109.755 171.207 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 46.6 t -106.43 114.71 46.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 124.833 1.253 . . . . 0.0 108.763 174.9 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 70.3 p -98.64 146.04 26.25 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.948 1.699 . . . . 0.0 110.416 -177.972 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 -59.05 146.98 36.48 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -172.355 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 20.0 ttp-105 -72.7 124.58 25.6 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 124.594 1.158 . . . . 0.0 108.803 -176.036 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 33.9 ptt-85 -143.2 160.23 40.84 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.342 1.057 . . . . 0.0 113.122 -166.97 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -72.94 154.29 40.61 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.625 1.17 . . . . 0.0 112.553 175.349 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 . . . . . 0 C--O 1.254 1.301 0 C-N-CA 127.273 2.229 . . . . 0.0 113.409 176.696 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 25.6 ptp . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 118.418 -0.801 . . . . 0.0 111.394 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_exo -59.89 162.48 15.96 Favored 'Trans proline' 0 CA--C 1.545 1.051 0 C-N-CA 123.955 3.103 . . . . 0.0 113.088 173.95 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -51.4 117.16 3.2 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 124.659 3.573 . . . . 0.0 113.392 177.81 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.2 t -158.96 155.05 26.88 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.147 1.379 . . . . 0.0 112.016 -175.541 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -129.45 132.92 47.07 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.002 1.721 . . . . 0.0 110.761 -171.05 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 92.8 p -140.86 154.99 69.22 Favored Pre-proline 0 CA--C 1.55 0.98 0 N-CA-C 113.893 1.071 . . . . 0.0 113.893 -172.283 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -66.98 160.07 79.03 Favored 'Cis proline' 0 C--N 1.353 0.804 0 CA-C-N 119.409 0.825 . . . . 0.0 111.497 -6.405 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.86 -28.68 66.33 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 176.521 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 47.8 tp -141.13 122.59 15.01 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.586 1.554 . . . . 0.0 109.049 170.252 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 54.6 tp -105.84 126.11 51.79 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.033 1.333 . . . . 0.0 109.32 170.926 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.4 t -109.08 123.77 65.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 124.028 0.931 . . . . 0.0 108.915 173.164 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.3 m -127.93 170.05 18.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 125.047 1.339 . . . . 0.0 111.474 172.86 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 18.4 m -98.16 151.74 20.1 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.472 1.509 . . . . 0.0 110.39 173.856 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -47.92 127.48 12.11 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.568 1.147 . . . . 0.0 111.45 168.777 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 86.24 -1.05 87.55 Favored Glycine 0 CA--C 1.532 1.137 0 C-N-CA 125.306 1.431 . . . . 0.0 114.664 -178.044 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.5 t0 -89.14 160.3 17.07 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.664 1.732 . . . . 0.0 111.912 173.786 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 71.4 m-20 -93.68 118.71 31.75 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.418 1.087 . . . . 0.0 110.191 175.343 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -97.88 120.44 38.28 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.875 1.27 . . . . 0.0 110.791 -179.992 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 23.1 m -125.38 125.82 44.03 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.593 0.757 . . . . 0.0 111.049 178.99 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -102.31 159.36 15.48 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.2 1.8 . . . . 0.0 111.034 172.078 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 71.3 m -113.4 126.82 55.77 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.722 1.609 . . . . 0.0 109.375 175.848 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -118.3 127.62 53.88 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.91 1.284 . . . . 0.0 111.525 179.012 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 57.6 m -118.91 139.36 51.77 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.983 1.313 . . . . 0.0 109.877 -172.278 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -136.78 155.07 50.31 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -169.651 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.3 t -153.78 105.84 2.82 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.747 1.619 . . . . 0.0 108.02 168.262 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -118.25 154.7 31.82 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.682 1.193 . . . . 0.0 112.816 -169.388 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 13.6 t -73.06 -28.83 62.54 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.068 0.947 . . . . 0.0 110.9 167.658 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 17.1 m -56.9 116.16 3.02 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.269 1.828 . . . . 0.0 111.809 169.822 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -75.5 -20.43 58.75 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.162 0.985 . . . . 0.0 112.637 176.478 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 67.0 p -151.98 146.78 25.85 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.023 1.729 . . . . 0.0 109.686 171.812 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 30.8 p90 -165.91 160.88 17.23 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -168.607 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 57.6 t -95.99 132.59 39.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 125.482 1.513 . . . . 0.0 107.038 167.465 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.31 113.48 25.81 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.849 0.86 . . . . 0.0 109.256 176.31 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 35.0 m120 -106.19 145.97 30.86 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.153 1.381 . . . . 0.0 111.177 179.91 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 18.5 t90 -114.83 136.36 53.18 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.669 1.188 . . . . 0.0 111.018 176.511 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -130.1 145.18 51.67 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.83 1.252 . . . . 0.0 113.998 -173.012 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 52.3 ttp85 -101.12 144.45 29.99 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 126.409 1.884 . . . . 0.0 107.64 167.017 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 33.5 mtp -90.26 145.79 24.73 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 118.948 0.794 . . . . 0.0 112.212 173.507 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 41.2 m -111.45 149.88 41.29 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 125.649 1.58 . . . . 0.0 111.071 173.805 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -69.32 -14.54 37.66 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 124.333 3.356 . . . . 0.0 114.164 -170.424 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.2 m -76.79 10.39 2.26 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.687 1.195 . . . . 0.0 112.929 171.162 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 68.15 48.82 0.9 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 127.434 2.294 . . . . 0.0 111.021 -176.565 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 26.9 mm-40 -130.72 175.71 8.8 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.441 1.496 . . . . 0.0 110.736 -178.523 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.0 p -136.13 150.99 49.32 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.938 1.695 . . . . 0.0 111.107 -177.354 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 39.6 t0 -133.99 127.72 32.93 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.573 1.549 . . . . 0.0 110.745 -177.798 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 30.6 ttmt -74.23 129.05 37.08 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.689 0.796 . . . . 0.0 110.734 -178.917 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 78.4 mt -101.35 -49.09 4.16 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 125.159 1.384 . . . . 0.0 112.294 -175.147 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -165.78 176.74 7.71 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 127.044 2.137 . . . . 0.0 109.409 -178.853 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -157.44 167.22 30.84 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.767 0.827 . . . . 0.0 113.003 -176.87 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -139.52 117.0 8.56 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 125.557 1.543 . . . . 0.0 109.4 169.405 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -55.08 154.52 20.26 Favored 'Cis proline' 0 C--N 1.352 0.73 0 CA-C-N 120.502 1.215 . . . . 0.0 113.656 -6.302 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -58.9 134.06 56.59 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.094 1.358 . . . . 0.0 113.741 -171.041 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -81.17 -0.79 41.95 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.671 1.189 . . . . 0.0 113.476 178.36 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 57.0 mtt85 -60.64 -9.53 4.0 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.53 1.932 . . . . 0.0 114.616 -177.644 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.4 p -65.43 -20.28 66.3 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.407 1.083 . . . . 0.0 113.01 169.452 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -116.44 152.97 48.74 Favored Pre-proline 0 CA--C 1.547 0.857 0 C-N-CA 125.717 1.607 . . . . 0.0 110.798 172.884 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -77.73 163.41 29.05 Favored 'Trans proline' 0 CA--C 1.538 0.698 0 C-N-CA 123.741 2.961 . . . . 0.0 111.453 175.737 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 98.23 18.36 26.71 Favored Glycine 0 CA--C 1.528 0.894 0 C-N-CA 124.159 0.885 . . . . 0.0 113.392 177.327 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 14.4 mm-40 -118.61 161.87 19.33 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.135 1.374 . . . . 0.0 111.003 173.811 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -142.91 136.19 28.37 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.261 1.024 . . . . 0.0 112.88 -173.3 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 51.1 m -69.2 -9.48 53.16 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 115.824 1.787 . . . . 0.0 115.824 -173.244 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 12.5 mmt85 -62.56 -20.34 64.59 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 119.728 1.149 . . . . 0.0 112.915 169.988 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -111.91 136.3 51.4 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.064 1.746 . . . . 0.0 110.081 174.311 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 12.1 mtm180 -144.52 149.26 35.61 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.7 1.2 . . . . 0.0 112.715 179.108 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 43.9 t -126.5 131.19 71.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 C-N-CA 125.69 1.596 . . . . 0.0 109.652 175.713 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 89.1 m -130.5 136.45 48.98 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.728 1.211 . . . . 0.0 110.407 178.269 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -80.28 141.89 35.08 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 118.566 0.621 . . . . 0.0 112.081 174.759 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 19.6 mt -85.48 158.62 57.15 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 123.751 0.82 . . . . 0.0 111.271 169.75 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -66.15 -4.55 10.58 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 123.656 2.904 . . . . 0.0 114.201 174.306 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -61.13 -26.15 67.48 Favored 'General case' 0 CA--C 1.551 1.007 0 CA-C-N 119.49 1.041 . . . . 0.0 112.835 169.699 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 98.73 -34.07 5.6 Favored Glycine 0 CA--C 1.531 1.078 0 C-N-CA 126.113 1.816 . . . . 0.0 114.224 172.708 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 57.1 mtm180 -135.36 73.59 1.48 Allowed 'General case' 0 N--CA 1.475 0.785 0 CA-C-O 122.616 1.198 . . . . 0.0 109.589 169.314 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -168.19 143.9 3.75 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 127.337 2.255 . . . . 0.0 108.651 -179.735 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -145.76 148.21 32.73 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.736 0.815 . . . . 0.0 112.833 -167.691 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -104.66 129.17 52.86 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.076 1.351 . . . . 0.0 110.673 168.827 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.4 mpt? -113.21 114.02 26.16 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 126.252 1.821 . . . . 0.0 108.987 -178.924 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 34.7 t -118.91 126.82 52.66 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.768 1.025 . . . . 0.0 113.768 -169.348 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 22.8 t -101.0 113.04 35.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 167.838 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 3.6 m -89.29 139.28 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-N 118.506 0.594 . . . . 0.0 111.864 179.424 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 19.9 tpt180 56.07 51.37 12.03 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.129 1.772 . . . . 0.0 111.712 173.658 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.12 158.96 24.49 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 114.589 1.329 . . . . 0.0 114.589 -168.81 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 4.8 ptm180 -135.77 151.83 50.5 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 127.816 2.446 . . . . 0.0 109.605 -172.159 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 36.1 mtp180 -53.35 -37.55 62.48 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 114.387 1.254 . . . . 0.0 114.387 -169.628 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -65.43 -13.79 59.49 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 125.053 1.341 . . . . 0.0 114.546 177.217 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -72.49 -16.69 61.79 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.978 1.263 . . . . 0.0 112.689 172.96 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.6 m -62.05 132.8 54.08 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.073 -1.017 . . . . 0.0 112.505 -177.388 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 159.76 -167.09 35.19 Favored Glycine 0 N--CA 1.473 1.112 0 C-N-CA 124.227 0.918 . . . . 0.0 114.031 -174.654 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.9 m -94.46 144.46 25.54 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.274 1.43 . . . . 0.0 110.977 -178.032 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -144.65 155.08 43.42 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.588 1.555 . . . . 0.0 111.789 -175.375 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -160.65 161.58 32.45 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.94 1.296 . . . . 0.0 113.441 179.511 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 3.5 m -104.67 162.74 13.02 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.342 1.457 . . . . 0.0 111.449 179.057 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -153.19 134.52 4.46 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 123.89 0.757 . . . . 0.0 113.369 169.883 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -99.27 126.78 45.17 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.981 0.913 . . . . 0.0 110.777 173.64 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 16.7 tt -122.28 131.36 73.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 O-C-N 121.266 -0.896 . . . . 0.0 110.857 174.888 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.2 m -61.22 157.96 15.11 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.515 1.126 . . . . 0.0 113.151 -177.92 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 39.0 mt -73.15 -14.23 61.33 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 -178.752 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -69.55 154.3 94.95 Favored Pre-proline 0 CA--C 1.552 1.055 0 C-N-CA 125.061 1.344 . . . . 0.0 112.821 176.097 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.87 -24.69 24.29 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 123.011 2.474 . . . . 0.0 112.975 176.958 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 17.2 ttpp -89.09 13.36 13.25 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 125.248 1.419 . . . . 0.0 113.461 -179.433 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.78 168.08 10.21 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.564 1.546 . . . . 0.0 114.754 -173.64 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -142.97 147.67 35.57 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.209 1.804 . . . . 0.0 109.219 177.372 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 42.8 mt -80.83 125.1 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 123.995 0.918 . . . . 0.0 111.006 -175.04 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 32.2 mmtm -88.05 93.92 9.64 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.955 1.302 . . . . 0.0 107.983 169.361 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -79.24 139.64 37.86 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.621 0.769 . . . . 0.0 112.021 -174.178 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 69.4 m -84.5 156.06 21.88 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.395 1.078 . . . . 0.0 113.33 175.073 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 89.0 mt -62.2 135.75 57.63 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 168.44 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.82 165.14 25.46 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 115.428 1.64 . . . . 0.0 115.428 -169.679 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -129.59 169.53 14.91 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 127.07 2.148 . . . . 0.0 110.55 169.548 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -122.46 142.33 50.67 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.818 1.247 . . . . 0.0 111.477 176.651 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 60.7 tp -110.34 136.27 49.77 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 125.946 1.698 . . . . 0.0 109.91 172.012 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 68.2 ttt180 -127.61 121.66 31.1 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.682 1.593 . . . . 0.0 109.756 170.07 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 45.2 t -108.0 111.85 37.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 C-N-CA 124.977 1.311 . . . . 0.0 108.641 172.755 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 75.4 p -90.8 155.2 18.96 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 125.945 1.698 . . . . 0.0 110.694 -179.647 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -65.21 148.9 50.86 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.946 0.898 . . . . 0.0 113.385 -172.463 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 34.2 ttp-105 -66.08 118.31 9.65 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 124.602 1.161 . . . . 0.0 109.828 -175.405 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 75.8 mtp85 -75.41 153.67 37.56 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.16 0.584 . . . . 0.0 112.418 -169.882 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -70.41 154.28 42.06 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.482 1.113 . . . . 0.0 112.442 174.66 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 . . . . . 0 C--O 1.253 1.283 0 C-N-CA 125.197 1.399 . . . . 0.0 112.97 177.304 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 39.7 ttp . . . . . 0 N--CA 1.489 1.486 0 CA-C-O 118.45 -0.786 . . . . 0.0 110.456 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_endo -66.82 167.4 19.61 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.962 2.441 . . . . 0.0 111.183 175.589 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -54.64 153.57 23.37 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 123.36 2.707 . . . . 0.0 114.081 178.873 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.8 t -147.98 145.6 28.61 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 125.271 1.429 . . . . 0.0 109.793 171.591 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -121.24 144.02 48.83 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.418 1.087 . . . . 0.0 112.301 -168.459 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 79.9 p -140.91 153.88 67.92 Favored Pre-proline 0 CA--C 1.547 0.85 0 N-CA-C 113.728 1.011 . . . . 0.0 113.728 168.732 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -70.43 159.92 90.9 Favored 'Cis proline' 0 C--N 1.352 0.738 0 CA-C-N 118.96 0.664 . . . . 0.0 111.092 -10.066 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.57 -30.44 69.79 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 173.05 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 48.0 tp -138.52 120.26 15.25 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.52 1.528 . . . . 0.0 109.005 170.103 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 41.8 tp -102.01 127.16 49.0 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.132 1.373 . . . . 0.0 109.403 172.781 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.8 t -112.43 123.1 67.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 124.022 0.929 . . . . 0.0 108.925 173.57 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.5 m -128.5 166.38 25.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 C-N-CA 124.687 1.195 . . . . 0.0 112.195 173.55 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.0 m -88.51 150.11 23.28 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.938 1.295 . . . . 0.0 110.522 172.339 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -51.73 124.95 13.6 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.587 1.155 . . . . 0.0 111.639 173.684 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 86.25 -0.87 87.48 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 124.849 1.214 . . . . 0.0 114.593 -178.412 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -85.62 158.92 19.97 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 119.598 1.699 . . . . 0.0 111.52 171.428 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 8.0 p30 -86.02 130.05 34.65 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.506 0.722 . . . . 0.0 111.276 172.145 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -111.07 119.58 39.5 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.325 1.45 . . . . 0.0 110.76 -178.161 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 34.4 m -120.55 125.57 48.15 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.985 0.914 . . . . 0.0 111.675 -176.482 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -99.99 153.12 19.45 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.739 1.615 . . . . 0.0 110.406 169.126 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 37.2 m -103.8 131.35 51.07 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.27 1.428 . . . . 0.0 108.858 171.583 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 46.4 t -121.29 124.21 44.06 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.979 1.312 . . . . 0.0 111.082 171.521 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 24.0 t -125.26 146.3 49.61 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.161 1.385 . . . . 0.0 111.181 179.964 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 34.6 p90 -160.59 156.17 25.29 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.07 1.348 . . . . 0.0 112.188 -170.042 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 69.4 m -138.92 101.38 4.28 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 121.323 -0.861 . . . . 0.0 110.961 169.026 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -78.31 145.7 35.18 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.493 0.717 . . . . 0.0 112.421 -179.212 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 19.0 m -76.03 -32.47 59.38 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.261 1.424 . . . . 0.0 111.467 173.375 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 51.3 p -81.57 -179.07 7.23 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.236 1.815 . . . . 0.0 112.721 173.351 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -139.07 131.37 28.37 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.753 1.621 . . . . 0.0 110.096 -179.827 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.4 t 82.07 117.72 0.05 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 128.482 2.713 . . . . 0.0 111.399 -175.771 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 5.0 p90 -169.18 164.12 11.05 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.141 1.376 . . . . 0.0 112.66 -167.675 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 48.0 t -109.61 137.85 39.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 126.286 1.834 . . . . 0.0 108.52 170.866 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 15.9 tp -102.94 130.79 50.12 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 123.641 0.776 . . . . 0.0 109.619 170.074 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -126.08 158.07 36.39 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.358 1.463 . . . . 0.0 111.568 -171.495 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 15.2 t90 -130.5 138.62 50.34 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.435 1.094 . . . . 0.0 112.149 -176.761 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -139.82 147.73 41.15 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.518 1.127 . . . . 0.0 113.436 -171.928 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 79.4 ttt-85 -110.93 138.29 47.51 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.542 1.537 . . . . 0.0 108.852 168.519 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 37.7 mtp -86.39 145.9 26.68 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 119.348 0.976 . . . . 0.0 112.492 177.046 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.1 p -86.01 163.0 44.98 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 123.824 0.849 . . . . 0.0 111.929 170.689 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -67.53 -19.45 48.59 Favored 'Trans proline' 0 C--N 1.354 0.85 0 C-N-CA 122.639 2.226 . . . . 0.0 112.575 171.574 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 21.9 m -82.41 12.54 4.38 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.135 1.374 . . . . 0.0 112.806 170.029 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . 0.312 0.4 OUTLIER 61.58 21.71 12.32 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 128.252 2.621 . . . . 0.0 115.574 179.185 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 17.7 mm100 -89.25 -172.68 3.73 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.072 0.949 . . . . 0.0 109.634 168.858 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.4 p -141.59 141.83 33.47 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.601 1.561 . . . . 0.0 110.318 -174.897 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -118.01 131.44 56.48 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 125.026 1.33 . . . . 0.0 110.369 175.582 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 55.4 tttm -83.07 119.42 24.46 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.554 1.141 . . . . 0.0 110.744 -174.285 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 74.6 mt -92.56 -49.45 6.1 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 124.731 1.213 . . . . 0.0 112.313 -169.206 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -172.55 175.32 3.53 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 127.005 2.122 . . . . 0.0 109.982 -173.206 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.61 172.15 18.32 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.992 1.317 . . . . 0.0 112.2 -178.686 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -143.5 118.42 6.24 Favored Pre-proline 0 CA--C 1.547 0.838 0 C-N-CA 124.809 1.244 . . . . 0.0 110.279 169.102 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -61.73 158.46 55.16 Favored 'Cis proline' 0 C--N 1.351 0.708 0 CA-C-N 119.154 0.733 . . . . 0.0 111.192 -10.183 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -74.96 94.5 2.84 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 122.05 0.928 . . . . 0.0 110.241 -179.86 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -76.6 -8.16 56.67 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.662 1.185 . . . . 0.0 114.16 -170.765 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 49.7 ptt85 -64.61 -32.2 73.75 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.434 1.493 . . . . 0.0 113.311 175.647 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.6 t 66.35 -61.18 0.3 Allowed 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 127.77 2.428 . . . . 0.0 113.214 -177.062 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -87.59 167.43 20.73 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 126.266 1.826 . . . . 0.0 110.797 173.605 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -56.61 132.75 53.68 Favored 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 123.378 2.718 . . . . 0.0 112.191 171.589 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -154.57 19.99 0.61 Allowed Glycine 0 N--CA 1.473 1.136 0 C-N-CA 124.503 1.049 . . . . 0.0 114.679 -177.798 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -163.04 169.89 18.83 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 126.804 2.041 . . . . 0.0 110.583 -169.822 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -82.15 158.99 23.43 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-O 121.45 0.643 . . . . 0.0 109.841 167.552 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.7 m -72.17 -1.97 17.0 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.449 1.1 . . . . 0.0 113.507 -179.421 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 84.4 mtt-85 -75.66 -35.08 60.49 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.643 1.577 . . . . 0.0 112.647 -179.33 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -91.7 116.35 28.81 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.454 1.101 . . . . 0.0 111.345 -169.65 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 -137.81 139.66 40.11 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.165 0.986 . . . . 0.0 111.029 -170.455 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 97.2 t -126.5 125.53 67.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 125.288 1.435 . . . . 0.0 109.487 -177.889 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 90.7 m -130.28 129.39 43.19 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.911 1.284 . . . . 0.0 110.935 -173.768 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -78.09 137.65 38.34 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.611 1.164 . . . . 0.0 111.188 178.291 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 51.0 mt -92.61 159.4 36.58 Favored Pre-proline 0 CA--C 1.545 0.772 0 C-N-CA 124.603 1.161 . . . . 0.0 111.823 177.437 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -64.96 -6.82 13.54 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 123.515 2.81 . . . . 0.0 113.993 173.573 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -68.43 -11.62 59.99 Favored 'General case' 0 CA--C 1.557 1.244 0 CA-C-N 119.336 0.971 . . . . 0.0 112.688 169.608 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 88.4 -34.16 3.91 Favored Glycine 0 N--CA 1.475 1.235 0 C-N-CA 126.964 2.221 . . . . 0.0 115.612 168.77 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 23.7 ptt-85 -140.5 73.61 1.43 Allowed 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 123.865 1.793 . . . . 0.0 109.925 172.008 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -169.54 137.83 1.84 Allowed 'General case' 0 C--O 1.237 0.446 0 C-N-CA 127.251 2.22 . . . . 0.0 107.195 -170.884 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 -143.86 137.97 28.3 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -167.642 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -92.28 126.07 37.2 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.432 1.093 . . . . 0.0 109.178 167.161 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 40.0 mtt -120.31 112.22 18.75 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 125.309 1.443 . . . . 0.0 108.793 -178.496 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 60.9 m -115.88 132.02 56.77 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 114.727 1.38 . . . . 0.0 114.727 -166.998 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 33.5 t -97.7 91.34 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 N-CA-C 105.777 -1.934 . . . . 0.0 105.777 166.743 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 86.0 t -73.54 121.48 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 123.764 0.825 . . . . 0.0 109.551 -178.971 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 59.39 73.88 0.46 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.007 1.723 . . . . 0.0 111.4 -175.675 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -79.97 147.86 31.41 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.372 1.469 . . . . 0.0 112.93 -175.91 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -116.48 162.75 17.1 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 126.904 2.082 . . . . 0.0 110.459 179.044 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 83.6 mtm-85 -56.18 -24.98 44.98 Favored 'General case' 0 N--CA 1.483 1.176 0 O-C-N 121.174 -0.954 . . . . 0.0 113.555 171.505 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -65.37 -25.36 67.54 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 124.816 1.246 . . . . 0.0 114.112 171.63 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -81.86 -26.69 34.01 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.924 0.89 . . . . 0.0 112.649 -179.622 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 45.4 m -48.78 133.0 17.89 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.337 1.055 . . . . 0.0 112.43 177.239 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 150.67 -162.0 29.19 Favored Glycine 0 N--CA 1.469 0.84 0 C-N-CA 123.839 0.733 . . . . 0.0 113.196 -172.784 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.9 m -96.1 140.86 30.21 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.289 1.436 . . . . 0.0 110.902 -172.706 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -134.13 156.22 48.68 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.642 1.577 . . . . 0.0 112.824 -177.159 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -155.17 156.19 35.26 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.264 1.426 . . . . 0.0 112.66 173.63 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -119.93 137.27 54.14 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.338 1.855 . . . . 0.0 109.847 176.144 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -141.74 132.44 5.25 Favored Glycine 0 N--CA 1.471 0.995 0 C-N-CA 124.086 0.851 . . . . 0.0 113.51 -171.556 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -88.52 156.18 19.23 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.025 0.93 . . . . 0.0 112.001 175.253 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 17.7 tt -154.08 133.7 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 124.889 1.276 . . . . 0.0 110.43 173.965 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 77.3 p -77.45 161.59 27.85 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.423 1.089 . . . . 0.0 113.135 178.427 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.82 -2.09 11.2 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 115.297 1.592 . . . . 0.0 115.297 178.479 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -73.03 145.74 86.56 Favored Pre-proline 0 CA--C 1.551 1.012 0 C-N-CA 124.287 1.035 . . . . 0.0 112.512 -177.101 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -56.53 -30.31 82.12 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 123.408 2.739 . . . . 0.0 113.949 172.794 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 59.7 mtpt -88.98 5.05 46.05 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.131 1.372 . . . . 0.0 114.059 -178.305 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.4 162.22 18.19 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.429 1.092 . . . . 0.0 113.848 -175.758 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -150.5 151.3 32.47 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.928 1.691 . . . . 0.0 109.185 -178.881 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 52.0 mt -68.93 122.57 20.57 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 123.685 0.794 . . . . 0.0 110.436 -177.512 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -80.83 88.4 5.84 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.91 1.284 . . . . 0.0 110.181 175.726 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -76.93 158.78 30.48 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.539 1.536 . . . . 0.0 112.879 -179.118 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 6.1 t -147.57 -170.22 3.51 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.821 0.848 . . . . 0.0 113.003 169.889 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 92.6 mt -68.93 127.77 34.29 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.984 1.714 . . . . 0.0 111.23 -177.488 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 10.7 mpt_? -68.51 159.64 31.39 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 126.236 1.814 . . . . 0.0 115.132 -168.851 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.91 169.68 9.05 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 127.256 2.222 . . . . 0.0 110.63 168.709 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -131.01 144.04 51.17 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.584 1.153 . . . . 0.0 112.334 -177.103 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 64.2 tp -112.93 137.62 51.04 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 126.374 1.87 . . . . 0.0 110.206 171.604 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 72.1 ttt180 -127.95 119.27 25.17 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.702 1.601 . . . . 0.0 109.851 169.812 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 41.5 t -100.89 118.68 47.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 124.673 1.189 . . . . 0.0 108.22 169.204 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 75.2 p -97.52 157.84 15.8 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.69 1.596 . . . . 0.0 110.785 178.955 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 56.7 mp0 -62.29 151.56 36.14 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.341 1.056 . . . . 0.0 112.332 -179.347 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 39.0 ttm105 -71.36 117.35 12.78 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 124.102 0.961 . . . . 0.0 110.332 -177.125 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 47.9 mtm105 -75.82 154.51 36.13 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.931 0.893 . . . . 0.0 112.26 -173.064 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -70.71 154.34 41.95 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.527 1.131 . . . . 0.0 112.403 174.499 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 . . . . . 0 C--O 1.252 1.226 0 C-N-CA 125.215 1.406 . . . . 0.0 112.99 177.109 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 1.7 pmm? . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 118.788 -0.625 . . . . 0.0 111.545 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo -58.82 155.3 38.73 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 123.907 3.071 . . . . 0.0 112.115 169.946 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -67.57 126.73 15.24 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 123.385 2.723 . . . . 0.0 110.758 -179.244 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.3 t -153.51 156.87 38.91 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.978 0.911 . . . . 0.0 112.309 -175.573 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 57.4 t80 -150.56 118.2 6.15 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 127.217 2.207 . . . . 0.0 109.405 -174.495 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 98.2 p -140.94 160.87 56.7 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 124.49 1.116 . . . . 0.0 113.704 -170.632 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -70.64 164.0 82.87 Favored 'Cis proline' 0 C--N 1.354 0.859 0 CA-C-N 119.91 1.003 . . . . 0.0 111.548 -6.561 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.44 -23.57 66.97 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 175.0 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 44.4 tp -142.2 122.82 14.2 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.617 1.567 . . . . 0.0 108.785 171.024 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 61.4 tp -110.68 125.83 53.88 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.086 1.354 . . . . 0.0 109.07 170.685 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 12.6 p -108.04 128.37 63.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 123.969 0.907 . . . . 0.0 109.775 169.826 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.7 m -128.78 168.22 22.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 125.096 1.359 . . . . 0.0 111.716 172.924 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 88.4 m -90.72 148.83 22.33 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.372 1.069 . . . . 0.0 110.37 171.581 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -57.14 117.03 3.63 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.989 1.716 . . . . 0.0 111.174 175.743 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.0 5.62 65.91 Favored Glycine 0 CA--C 1.532 1.136 0 C-N-CA 125.464 1.506 . . . . 0.0 114.694 -175.252 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -97.06 158.16 15.56 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 119.435 1.618 . . . . 0.0 112.324 173.22 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 29.4 m120 -72.81 131.83 42.79 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.73 1.212 . . . . 0.0 111.199 173.845 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -117.86 114.01 22.62 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.562 1.145 . . . . 0.0 111.186 178.757 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 32.8 m -124.72 125.33 43.91 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.536 0.734 . . . . 0.0 111.905 -174.273 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -101.46 158.13 16.3 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.513 1.925 . . . . 0.0 110.4 169.965 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 28.1 m -102.67 137.39 40.96 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.349 1.46 . . . . 0.0 109.597 172.684 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 39.1 t -130.28 142.76 50.53 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.068 1.347 . . . . 0.0 111.812 170.498 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.9 m -140.61 128.07 21.33 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.009 0.524 . . . . 0.0 112.285 -174.233 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 26.4 m-85 -139.37 156.1 47.22 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 126.826 2.05 . . . . 0.0 113.412 175.764 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 53.3 m -136.82 134.55 37.1 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 126.977 2.111 . . . . 0.0 107.006 166.696 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -162.47 -179.52 7.01 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 116.658 2.096 . . . . 0.0 116.658 -169.688 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 72.4 p -78.38 -179.5 6.35 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 127.681 2.392 . . . . 0.0 112.901 -171.747 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 16.9 m 68.06 15.69 9.46 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 126.582 1.953 . . . . 0.0 113.9 174.947 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 77.87 -30.87 0.16 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 128.292 2.637 . . . . 0.0 112.103 -174.619 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -164.62 -178.01 5.11 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.76 1.224 . . . . 0.0 113.319 169.766 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 35.1 p90 -144.72 162.66 36.16 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.465 1.506 . . . . 0.0 112.843 -169.596 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.3 t -95.98 125.08 48.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 N-CA-C 106.277 -1.749 . . . . 0.0 106.277 168.474 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 19.5 tp -101.94 134.84 44.5 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 123.569 0.748 . . . . 0.0 110.037 175.28 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 8.6 m-80 -132.03 145.79 51.66 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.832 1.253 . . . . 0.0 110.903 -169.773 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 11.5 t90 -111.43 140.65 45.84 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 124.596 1.158 . . . . 0.0 111.374 178.289 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -133.78 140.29 46.85 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 -175.668 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 68.3 ttt180 -96.58 140.0 31.84 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.268 1.027 . . . . 0.0 108.742 167.834 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 33.3 mtp -97.02 145.92 25.49 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -177.085 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.8 p -85.49 163.77 43.21 Favored Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 123.717 0.807 . . . . 0.0 111.355 169.258 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -67.76 -18.4 47.62 Favored 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 122.661 2.24 . . . . 0.0 112.763 172.781 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 32.7 m -83.34 1.55 40.67 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.635 1.174 . . . . 0.0 112.91 170.861 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 74.46 22.44 2.13 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 127.784 2.433 . . . . 0.0 113.759 179.424 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -83.34 177.07 8.66 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.213 0.605 . . . . 0.0 109.463 168.399 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 11.7 p -144.22 139.1 28.5 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.841 1.257 . . . . 0.0 111.098 -169.904 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -122.51 130.11 52.7 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.028 0.931 . . . . 0.0 111.5 174.679 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -73.01 126.94 31.13 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.372 0.669 . . . . 0.0 111.021 -179.258 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 43.4 mt -98.27 -46.37 5.84 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.739 1.615 . . . . 0.0 111.989 -173.698 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -167.83 167.79 12.76 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 127.167 2.187 . . . . 0.0 109.784 -174.04 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -156.75 160.2 39.05 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.392 1.077 . . . . 0.0 112.372 -176.212 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -133.76 130.67 20.79 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 124.861 1.264 . . . . 0.0 110.21 170.607 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -66.1 150.03 78.51 Favored 'Cis proline' 0 C--N 1.351 0.673 0 CA-C-N 119.932 1.012 . . . . 0.0 111.473 -3.928 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -79.08 150.77 31.74 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.139 0.975 . . . . 0.0 112.672 -176.008 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -100.31 157.43 16.61 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 122.194 0.997 . . . . 0.0 112.26 174.487 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -87.47 -2.55 58.69 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.32 1.848 . . . . 0.0 113.193 -169.273 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 43.0 p -76.12 -6.33 50.72 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.186 1.794 . . . . 0.0 114.087 176.198 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 -58.42 149.27 60.91 Favored Pre-proline 0 CA--C 1.552 1.037 0 C-N-CA 125.555 1.542 . . . . 0.0 113.178 177.282 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -77.48 173.65 13.91 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.855 3.037 . . . . 0.0 111.919 178.122 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -87.76 1.51 85.41 Favored Glycine 0 CA--C 1.533 1.196 0 C-N-CA 124.453 1.025 . . . . 0.0 113.203 172.851 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -86.02 168.05 14.47 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.614 1.566 . . . . 0.0 111.008 176.702 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -67.51 128.6 37.06 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.277 -0.889 . . . . 0.0 111.211 173.553 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 40.4 p -86.51 -12.2 49.52 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 114.903 1.445 . . . . 0.0 114.903 -171.501 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 12.4 mtp85 62.43 -35.39 0.12 Allowed 'General case' 0 C--N 1.344 0.36 0 C-N-CA 130.67 3.588 . . . . 0.0 115.344 -174.52 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -118.3 140.47 49.78 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.137 1.775 . . . . 0.0 111.318 -174.156 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 31.4 ttp-105 -140.11 144.1 36.59 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.163 1.385 . . . . 0.0 111.465 -174.493 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 46.3 t -121.87 127.87 75.53 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 C-N-CA 124.887 1.275 . . . . 0.0 108.485 169.18 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 89.3 m -130.6 134.88 47.35 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.173 1.389 . . . . 0.0 110.403 -174.365 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 22.1 pt20 -79.92 141.66 35.86 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.574 0.749 . . . . 0.0 111.887 173.851 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 72.3 mt -93.9 158.38 36.44 Favored Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 124.904 1.282 . . . . 0.0 111.675 178.171 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -65.56 -4.72 10.13 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 123.549 2.832 . . . . 0.0 113.848 174.209 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 21.2 m120 -65.19 -18.53 65.39 Favored 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 119.15 0.886 . . . . 0.0 113.044 169.97 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 95.66 -34.14 5.07 Favored Glycine 0 N--CA 1.474 1.168 0 C-N-CA 126.457 1.98 . . . . 0.0 114.241 169.884 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 90.4 mtt-85 -141.41 73.65 1.43 Allowed 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.571 1.549 . . . . 0.0 109.173 169.308 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -164.82 144.81 7.28 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 126.787 2.035 . . . . 0.0 108.087 178.706 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -142.65 147.35 35.61 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 -168.055 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -105.19 138.63 41.08 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.163 1.385 . . . . 0.0 110.917 168.884 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 31.5 mtt -121.42 108.66 13.93 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 126.238 1.815 . . . . 0.0 107.816 179.32 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 17.5 t -122.26 128.35 51.0 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 -165.994 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 12.9 t -88.32 124.9 41.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 125.269 1.428 . . . . 0.0 107.356 168.073 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 67.4 t -84.29 112.48 21.61 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 C-N-CA 124.916 1.287 . . . . 0.0 108.887 174.535 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 80.7 mtt85 54.97 70.39 0.63 Allowed 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.714 1.605 . . . . 0.0 111.656 175.997 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.64 128.46 36.05 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.196 0.998 . . . . 0.0 111.792 -174.391 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 10.1 mpt_? -89.22 161.94 16.16 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.945 1.298 . . . . 0.0 109.828 173.557 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 71.8 mtm180 -58.73 -23.72 60.32 Favored 'General case' 0 N--CA 1.484 1.255 0 O-C-N 120.628 -1.295 . . . . 0.0 113.578 172.676 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -55.01 -26.88 40.02 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.576 1.551 . . . . 0.0 113.367 167.99 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 34.9 m-20 -95.73 -1.22 50.33 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.584 1.554 . . . . 0.0 113.207 -169.46 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 69.4 m -64.4 138.31 58.35 Favored 'General case' 0 CA--C 1.544 0.727 0 O-C-N 120.401 -1.437 . . . . 0.0 111.643 169.837 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 160.1 -167.41 35.47 Favored Glycine 0 N--CA 1.473 1.12 0 O-C-N 121.167 -0.958 . . . . 0.0 113.608 178.866 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.8 m -93.84 145.54 24.53 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.464 0.706 . . . . 0.0 110.004 175.701 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -139.56 158.99 43.19 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.85 2.06 . . . . 0.0 110.281 -178.671 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.9 pp -152.83 167.16 29.97 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.96 0.904 . . . . 0.0 112.558 171.095 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 50.4 t -114.32 144.76 42.73 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.676 1.591 . . . . 0.0 110.935 -178.767 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -147.79 139.04 7.49 Favored Glycine 0 N--CA 1.472 1.094 0 C-N-CA 124.031 0.824 . . . . 0.0 113.906 177.584 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -109.46 159.21 17.23 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.728 1.211 . . . . 0.0 112.387 179.161 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.4 tt -146.68 131.77 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 125.321 1.448 . . . . 0.0 109.355 169.377 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.3 m -67.29 152.33 45.91 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.449 1.1 . . . . 0.0 111.92 -177.905 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 3.7 pp -70.72 -11.5 60.98 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 115.372 1.619 . . . . 0.0 115.372 -170.936 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -74.32 148.03 85.77 Favored Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 123.808 0.843 . . . . 0.0 112.069 174.924 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -67.54 -18.74 48.94 Favored 'Trans proline' 0 CA--C 1.54 0.775 0 C-N-CA 123.189 2.593 . . . . 0.0 113.383 -179.015 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -76.83 -10.15 59.17 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.839 1.256 . . . . 0.0 113.718 176.433 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.25 162.32 20.29 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.931 1.292 . . . . 0.0 114.024 -175.106 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -137.92 157.96 45.33 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.109 1.764 . . . . 0.0 109.434 174.75 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 65.4 mt -72.91 132.55 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 123.386 0.674 . . . . 0.0 110.944 -177.986 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -122.34 135.29 54.69 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.772 2.029 . . . . 0.0 110.093 173.389 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -112.65 148.0 35.56 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.181 0.992 . . . . 0.0 113.524 -167.662 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 69.8 m -84.58 -175.45 5.79 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.428 1.491 . . . . 0.0 111.918 168.867 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -63.35 156.48 25.68 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.121 0.968 . . . . 0.0 110.552 168.924 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -93.84 155.45 17.19 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.17 0.988 . . . . 0.0 111.613 172.855 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -147.79 159.96 43.25 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.141 1.376 . . . . 0.0 112.291 -176.029 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -104.12 138.44 40.61 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.913 1.285 . . . . 0.0 112.046 -175.013 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 46.9 tp -109.91 126.7 54.15 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 125.998 1.719 . . . . 0.0 108.688 169.212 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 70.9 ttt180 -118.34 119.38 34.46 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.975 1.71 . . . . 0.0 109.603 175.531 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 43.8 t -104.09 120.39 54.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 C-N-CA 124.341 1.057 . . . . 0.0 108.582 170.367 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 68.1 p -98.9 150.07 22.29 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.308 1.443 . . . . 0.0 109.727 175.435 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 37.1 mp0 -50.73 150.49 2.83 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.978 1.311 . . . . 0.0 112.867 -177.971 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 57.7 ttp180 -63.15 126.84 28.7 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 124.449 1.099 . . . . 0.0 109.496 -178.11 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.39 147.43 48.52 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.092 0.405 . . . . 0.0 112.092 -170.58 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -70.78 154.31 41.96 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.512 1.125 . . . . 0.0 112.487 175.5 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 . . . . . 0 C--O 1.254 1.298 0 C-N-CA 125.417 1.487 . . . . 0.0 112.372 177.208 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 61.7 tpp . . . . . 0 N--CA 1.489 1.488 0 CA-C-O 118.293 -0.861 . . . . 0.0 110.1 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -74.85 168.2 25.35 Favored 'Trans proline' 0 CA--C 1.545 1.067 0 C-N-CA 123.484 2.789 . . . . 0.0 111.861 177.72 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -52.77 140.33 57.25 Favored 'Trans proline' 0 C--N 1.35 0.652 0 C-N-CA 124.321 3.348 . . . . 0.0 113.422 171.757 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 37.2 p -150.25 153.5 36.3 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.7 1.6 . . . . 0.0 111.067 179.609 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -121.46 134.13 55.07 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.255 1.422 . . . . 0.0 110.117 178.533 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.4 m -140.83 157.45 67.53 Favored Pre-proline 0 N--CA 1.477 0.892 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 179.918 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -70.64 157.87 94.14 Favored 'Cis proline' 0 C--N 1.351 0.662 0 CA-C-N 119.327 0.795 . . . . 0.0 110.887 -8.993 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -57.69 -32.7 67.62 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 172.146 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 50.6 tp -138.93 120.37 14.96 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.531 1.533 . . . . 0.0 109.342 170.733 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 50.6 tp -100.62 127.27 47.07 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.524 1.53 . . . . 0.0 109.24 171.146 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.7 t -111.52 124.61 68.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 124.099 0.96 . . . . 0.0 108.562 171.805 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.1 m -127.58 164.32 28.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 124.493 1.117 . . . . 0.0 111.562 173.959 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 16.8 m -88.33 151.27 22.73 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.681 1.193 . . . . 0.0 110.472 173.662 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.12 120.53 2.45 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.942 1.697 . . . . 0.0 112.563 171.634 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.18 1.08 89.64 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 125.868 1.699 . . . . 0.0 115.408 179.692 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -85.13 157.26 20.73 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 119.65 1.725 . . . . 0.0 111.914 175.744 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -82.54 123.53 29.29 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.696 0.798 . . . . 0.0 110.353 177.548 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -104.55 123.79 48.16 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.667 1.187 . . . . 0.0 110.928 -178.529 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 36.0 m -132.3 126.87 34.37 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.002 0.921 . . . . 0.0 111.516 -175.963 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -100.37 153.98 18.88 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 126.1 1.76 . . . . 0.0 110.837 171.027 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 39.4 m -101.53 128.41 47.79 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 125.266 1.426 . . . . 0.0 108.572 169.759 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 95.6 m -124.67 128.77 49.34 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.606 1.162 . . . . 0.0 109.538 170.603 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.9 m -111.0 127.85 55.66 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.744 0.818 . . . . 0.0 109.884 -173.923 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -146.17 141.98 28.0 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.239 1.016 . . . . 0.0 110.874 174.912 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 68.0 m -92.58 101.42 13.84 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 166.862 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -97.62 156.37 16.55 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.735 0.814 . . . . 0.0 112.97 -171.07 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 44.2 m -57.17 128.79 38.75 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 126.692 1.997 . . . . 0.0 111.507 -173.586 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 16.1 m -68.71 -22.98 64.31 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 -169.877 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -78.71 -57.39 3.78 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.367 1.067 . . . . 0.0 111.04 177.062 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 42.5 p -175.92 152.74 1.26 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.792 1.637 . . . . 0.0 111.849 -173.614 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 49.2 p90 -166.08 169.31 14.66 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.353 1.461 . . . . 0.0 112.051 -171.987 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 24.2 t -125.77 119.93 56.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 125.0 1.32 . . . . 0.0 107.878 168.648 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 59.0 tp -99.43 139.4 35.14 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 124.819 1.247 . . . . 0.0 108.662 169.601 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 9.7 m-80 -133.8 152.8 51.98 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.761 1.224 . . . . 0.0 111.193 -170.809 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 24.0 t90 -128.19 139.41 52.49 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.871 1.268 . . . . 0.0 111.04 175.469 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -135.31 143.41 46.16 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 114.677 1.362 . . . . 0.0 114.677 -170.404 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 55.9 ttp85 -93.14 144.46 25.26 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.913 1.685 . . . . 0.0 107.104 165.614 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 28.9 mtp -96.91 145.95 25.41 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 118.945 0.793 . . . . 0.0 112.244 172.62 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 59.3 m -102.89 158.64 31.35 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 125.029 1.331 . . . . 0.0 111.301 169.809 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_exo -56.6 -30.97 85.36 Favored 'Trans proline' 0 C--N 1.355 0.917 0 C-N-CA 124.405 3.403 . . . . 0.0 115.163 -172.97 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 14.3 m -77.02 11.86 1.62 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.001 1.32 . . . . 0.0 113.655 178.094 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 46.3 t30 69.12 25.4 5.81 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 127.164 2.186 . . . . 0.0 112.445 -176.913 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -92.72 170.51 9.66 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.203 1.001 . . . . 0.0 110.628 172.85 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 9.9 p -134.74 152.55 51.85 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.457 1.503 . . . . 0.0 111.555 -174.722 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 43.4 t0 -136.47 125.77 24.84 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.701 1.601 . . . . 0.0 110.042 -177.823 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 12.7 ttmm -75.05 126.13 30.38 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.235 0.541 . . . . 0.0 110.734 -175.875 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 91.0 mt -95.37 -49.43 5.45 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.248 1.419 . . . . 0.0 111.147 -177.8 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -160.82 176.72 11.16 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.41 1.484 . . . . 0.0 110.445 177.296 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -152.85 166.7 31.46 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.862 1.265 . . . . 0.0 112.043 -174.857 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -137.72 115.27 9.6 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 126.033 1.733 . . . . 0.0 109.117 172.587 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -55.9 157.51 22.1 Favored 'Cis proline' 0 C--N 1.352 0.715 0 CA-C-N 120.289 1.139 . . . . 0.0 113.935 -5.803 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -63.04 120.63 11.79 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 -170.526 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -87.58 -1.82 58.2 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.251 1.42 . . . . 0.0 111.749 167.975 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.38 -17.69 45.39 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.936 2.094 . . . . 0.0 113.574 -176.849 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 20.6 m -70.73 -15.11 62.67 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.589 1.156 . . . . 0.0 113.971 173.935 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -69.98 137.13 87.28 Favored Pre-proline 0 CA--C 1.547 0.834 0 O-C-N 121.166 -0.959 . . . . 0.0 110.363 175.233 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -70.81 134.5 25.89 Favored 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 122.746 2.298 . . . . 0.0 110.621 -176.21 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 103.43 -9.27 53.12 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 125.081 1.324 . . . . 0.0 113.184 -172.743 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 18.2 mm100 -79.03 152.77 30.73 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 118.195 0.998 . . . . 0.0 112.044 171.987 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -127.46 147.67 50.3 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.64 1.576 . . . . 0.0 111.324 177.686 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 25.0 m -71.22 -11.95 61.21 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 -174.34 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -67.52 -17.15 64.55 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 114.271 1.212 . . . . 0.0 114.271 -178.776 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -101.91 127.23 48.84 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.916 1.286 . . . . 0.0 110.118 176.498 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -134.2 143.12 47.67 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.412 1.085 . . . . 0.0 112.197 -171.133 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 26.0 t -126.56 127.7 70.54 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 125.14 1.376 . . . . 0.0 109.232 168.562 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 90.3 m -130.52 137.38 49.7 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.479 1.512 . . . . 0.0 110.779 -174.286 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 65.4 tt0 -86.02 134.73 33.83 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.119 0.968 . . . . 0.0 110.59 172.188 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 65.8 mt -87.13 158.92 52.07 Favored Pre-proline 0 CA--C 1.542 0.635 0 C-N-CA 124.203 1.001 . . . . 0.0 112.064 -179.281 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -63.97 -6.97 12.15 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 123.645 2.897 . . . . 0.0 114.017 173.8 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -64.58 -26.04 68.23 Favored 'General case' 0 CA--C 1.552 1.022 0 CA-C-N 119.559 1.072 . . . . 0.0 112.191 169.094 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 92.98 -34.04 4.75 Favored Glycine 0 CA--C 1.53 1.018 0 C-N-CA 126.556 2.027 . . . . 0.0 113.591 174.637 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 22.9 ptt180 -130.75 73.54 1.55 Allowed 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 122.835 1.302 . . . . 0.0 110.378 171.003 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -175.47 143.94 0.66 Allowed 'General case' 0 C--O 1.237 0.398 0 C-N-CA 127.393 2.277 . . . . 0.0 109.14 -177.663 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -142.51 148.31 37.43 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -168.782 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 10.0 m170 -107.31 134.88 49.73 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.26 1.424 . . . . 0.0 111.621 170.442 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -119.92 121.36 38.84 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 126.192 1.797 . . . . 0.0 107.923 178.002 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 22.7 t -133.78 137.04 44.93 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 116.285 1.958 . . . . 0.0 116.285 -166.721 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 48.4 t -96.58 116.26 38.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 C-N-CA 126.906 2.083 . . . . 0.0 107.318 168.265 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 88.5 t -76.83 127.29 37.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 123.657 0.783 . . . . 0.0 109.026 169.599 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 54.4 ttt85 54.75 71.33 0.54 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.931 1.693 . . . . 0.0 111.551 176.864 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -69.83 129.42 39.51 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.627 0.771 . . . . 0.0 110.98 -177.535 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 37.7 mmm-85 -103.74 161.91 13.53 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 126.019 1.727 . . . . 0.0 110.268 179.492 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 3.2 mmm180 -51.81 -34.28 39.37 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 121.009 -1.057 . . . . 0.0 113.418 -179.628 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -66.89 -19.49 65.74 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.408 1.483 . . . . 0.0 115.001 176.81 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -75.9 -13.7 60.26 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 119.831 1.196 . . . . 0.0 113.144 177.992 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.2 m -62.83 129.16 39.23 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 120.661 -1.275 . . . . 0.0 112.156 179.998 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 161.3 -166.46 35.84 Favored Glycine 0 CA--C 1.529 0.924 0 C-N-CA 124.111 0.863 . . . . 0.0 113.246 -173.583 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.6 m -96.83 144.28 26.94 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.664 1.186 . . . . 0.0 110.833 -177.244 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -143.03 158.29 43.74 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.363 1.865 . . . . 0.0 111.321 -175.553 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.2 pp -158.64 166.53 31.84 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.555 1.142 . . . . 0.0 112.208 174.295 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 71.3 m -113.61 162.12 16.6 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.889 1.275 . . . . 0.0 111.268 177.384 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -156.72 133.89 3.81 Favored Glycine 0 N--CA 1.471 0.977 0 O-C-N 121.529 -0.732 . . . . 0.0 114.12 176.462 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -114.52 147.85 38.79 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.285 1.034 . . . . 0.0 112.685 -178.451 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 16.9 tt -153.96 147.97 13.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.296 1.438 . . . . 0.0 111.035 -179.389 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 66.1 m -77.63 150.73 34.58 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 120.918 -1.114 . . . . 0.0 110.689 169.493 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.86 -4.9 37.72 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 115.413 1.635 . . . . 0.0 115.413 -174.333 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -75.05 147.18 83.3 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 124.68 1.192 . . . . 0.0 111.894 174.134 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -68.77 -17.14 42.31 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 123.434 2.756 . . . . 0.0 113.77 -176.613 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -73.66 -16.14 61.22 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.532 1.133 . . . . 0.0 113.575 176.268 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -71.67 168.1 18.43 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.137 1.375 . . . . 0.0 113.765 -176.052 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.54 149.06 35.24 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.125 1.77 . . . . 0.0 108.664 176.866 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 34.0 mt -75.48 121.61 27.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 123.893 0.877 . . . . 0.0 110.928 -175.123 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 36.6 tptt -81.81 115.31 20.97 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.683 0.793 . . . . 0.0 109.769 168.985 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -108.91 158.87 17.28 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.723 2.009 . . . . 0.0 110.587 174.226 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 5.6 t -143.96 -168.03 2.75 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.369 1.068 . . . . 0.0 112.156 176.384 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 98.7 mt -60.82 117.5 5.48 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.874 1.669 . . . . 0.0 111.884 -172.478 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 20.2 ptp180 -66.32 157.86 30.61 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.656 1.582 . . . . 0.0 113.632 -174.67 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -122.36 165.75 15.79 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 127.038 2.135 . . . . 0.0 111.52 -175.057 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -128.01 143.13 51.07 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.585 1.154 . . . . 0.0 111.885 -177.657 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 56.4 tp -113.27 135.94 53.29 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 126.196 1.798 . . . . 0.0 109.97 172.563 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -126.66 123.23 37.1 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.81 1.644 . . . . 0.0 109.539 169.726 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 46.5 t -103.01 124.35 57.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 107.143 -1.429 . . . . 0.0 107.143 169.275 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 67.5 p -101.3 155.3 18.12 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.313 1.445 . . . . 0.0 110.904 177.25 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -58.75 150.81 22.65 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.752 0.787 . . . . 0.0 112.845 178.645 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -75.57 130.32 38.63 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.323 1.049 . . . . 0.0 109.049 -179.471 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 44.9 ptt85 -66.96 163.04 20.62 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 -174.713 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -76.32 154.37 35.1 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.106 0.962 . . . . 0.0 111.359 168.611 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 . . . . . 0 C--O 1.254 1.325 0 C-N-CA 125.618 1.567 . . . . 0.0 112.391 170.804 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 22.9 mmt . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 118.705 -0.664 . . . . 0.0 111.09 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -58.83 159.26 21.6 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 124.451 3.434 . . . . 0.0 113.257 174.542 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -72.17 159.2 50.41 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 123.506 2.804 . . . . 0.0 111.888 175.656 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 85.5 m -141.42 150.46 42.37 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.272 1.429 . . . . 0.0 110.095 -177.242 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -145.08 114.45 7.11 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.152 1.781 . . . . 0.0 109.755 172.793 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 69.2 m -140.91 160.06 59.81 Favored Pre-proline 0 N--CA 1.479 0.976 0 C-N-CA 124.762 1.225 . . . . 0.0 113.069 -170.895 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -71.21 158.71 94.9 Favored 'Cis proline' 0 C--N 1.353 0.788 0 CA-C-N 120.152 1.09 . . . . 0.0 111.531 -4.261 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.55 -25.21 64.35 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 175.387 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 45.2 tp -142.45 122.55 13.73 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.445 1.498 . . . . 0.0 109.044 169.988 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 61.6 tp -108.74 125.47 51.96 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.21 1.404 . . . . 0.0 108.881 169.75 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 12.8 p -108.79 129.33 63.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 123.877 0.871 . . . . 0.0 109.653 169.629 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 28.5 m -130.23 163.09 36.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 124.952 1.301 . . . . 0.0 111.42 173.07 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 16.3 m -84.77 147.47 26.84 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.079 0.951 . . . . 0.0 109.963 170.223 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 64.7 tt0 -56.43 124.95 19.91 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 124.931 1.292 . . . . 0.0 110.696 173.524 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.91 -2.78 84.47 Favored Glycine 0 CA--C 1.532 1.139 0 C-N-CA 126.085 1.802 . . . . 0.0 114.781 -174.795 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -87.58 160.99 17.98 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 119.35 1.575 . . . . 0.0 111.748 172.263 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -87.05 121.44 29.51 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.328 1.051 . . . . 0.0 110.495 177.331 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -97.61 128.49 44.37 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.393 1.077 . . . . 0.0 110.601 177.481 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 97.0 m -132.68 127.05 33.97 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 119.336 0.971 . . . . 0.0 111.84 176.125 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -100.99 159.48 15.17 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.609 1.964 . . . . 0.0 110.409 169.302 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 59.1 m -103.8 134.28 47.38 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.144 1.378 . . . . 0.0 109.312 171.451 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 3.3 t -137.15 142.27 42.22 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.579 1.152 . . . . 0.0 112.366 177.943 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 90.5 p -147.05 154.18 40.87 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 121.065 -1.022 . . . . 0.0 113.115 -176.877 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -149.4 156.23 41.71 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 126.429 1.892 . . . . 0.0 112.34 -172.467 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.4 t -146.83 135.05 21.68 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.567 1.147 . . . . 0.0 109.259 168.926 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -140.6 134.08 29.99 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.251 1.02 . . . . 0.0 112.119 -169.83 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 13.9 m -63.04 -30.16 71.38 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 125.817 1.647 . . . . 0.0 112.415 177.155 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 12.6 p -69.48 -14.69 63.01 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.546 1.538 . . . . 0.0 114.168 174.222 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 71.92 -46.81 0.65 Allowed 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 128.845 2.858 . . . . 0.0 113.424 174.356 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 70.7 m -104.63 126.0 51.29 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.569 1.548 . . . . 0.0 111.252 178.327 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 55.6 p90 -155.55 157.61 37.11 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.6 1.16 . . . . 0.0 112.134 -174.382 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 48.8 t -95.98 127.86 47.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 125.154 1.381 . . . . 0.0 107.274 169.909 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.0 tt -99.37 119.75 38.47 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 173.277 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 23.2 m-80 -112.79 149.41 33.07 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.14 1.376 . . . . 0.0 111.146 179.349 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 11.5 t90 -119.25 142.1 48.34 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.72 1.208 . . . . 0.0 111.7 175.807 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -137.15 149.12 47.07 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.705 1.202 . . . . 0.0 113.769 -169.976 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 79.0 ttt-85 -108.04 140.28 41.44 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.397 1.479 . . . . 0.0 108.252 167.348 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 29.0 mtp -84.41 145.91 27.94 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.59 0.632 . . . . 0.0 112.35 178.345 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 66.0 m -107.64 153.2 41.57 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 125.266 1.426 . . . . 0.0 112.026 179.912 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -56.0 -30.03 76.34 Favored 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 124.69 3.593 . . . . 0.0 115.202 -177.286 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.3 m -76.98 10.16 2.49 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.843 1.257 . . . . 0.0 113.491 178.844 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 67.96 44.85 1.44 Allowed 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.825 2.05 . . . . 0.0 110.585 -175.223 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -124.09 -172.69 2.59 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.518 1.527 . . . . 0.0 109.946 177.892 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.2 p -146.01 148.13 32.38 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.719 1.608 . . . . 0.0 110.403 -174.333 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -124.69 132.59 53.39 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 124.126 0.97 . . . . 0.0 111.258 173.196 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 29.9 ttmt -76.2 126.0 30.19 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.684 1.193 . . . . 0.0 110.766 -179.41 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 66.3 mt -101.54 -51.98 3.33 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 125.501 1.52 . . . . 0.0 111.75 -170.412 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -160.46 160.86 32.6 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 127.009 2.123 . . . . 0.0 108.767 -171.963 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.57 165.4 32.95 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.65 0.78 . . . . 0.0 111.867 -174.936 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -138.19 115.61 9.31 Favored Pre-proline 0 CA--C 1.545 0.763 0 C-N-CA 124.678 1.191 . . . . 0.0 110.749 171.105 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -62.54 161.33 53.26 Favored 'Cis proline' 0 C--N 1.352 0.724 0 CA-C-N 119.253 0.769 . . . . 0.0 110.941 -11.659 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -68.35 94.45 0.54 Allowed 'General case' 0 CA--C 1.546 0.793 0 CA-C-O 122.082 0.944 . . . . 0.0 112.148 -173.602 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -88.73 -10.74 47.28 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.714 1.606 . . . . 0.0 112.891 174.895 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -75.67 -9.8 58.9 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.459 1.904 . . . . 0.0 113.629 172.501 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.5 t 98.49 154.7 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 130.113 3.365 . . . . 0.0 110.377 -172.671 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -53.64 158.77 2.87 Favored Pre-proline 0 CA--C 1.552 1.025 0 C-N-CA 125.719 1.608 . . . . 0.0 112.432 170.307 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -51.64 144.13 34.63 Favored 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 124.165 3.243 . . . . 0.0 113.912 179.474 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 139.71 -8.31 3.07 Favored Glycine 0 CA--C 1.535 1.314 0 C-N-CA 125.082 1.325 . . . . 0.0 114.774 -175.84 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.14 -143.79 0.2 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.363 1.465 . . . . 0.0 108.786 168.995 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 47.2 t0 -75.63 71.55 2.53 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 120.575 -1.328 . . . . 0.0 110.201 168.789 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 19.5 m -60.55 -6.83 1.79 Allowed 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 126.834 2.054 . . . . 0.0 115.624 -171.304 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 48.6 mtm180 -57.74 -36.53 72.19 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.696 1.599 . . . . 0.0 113.388 176.149 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 80.3 m-85 -69.81 125.78 27.75 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.01 1.324 . . . . 0.0 111.24 173.025 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 8.2 tmm_? -144.47 139.9 28.59 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.55 1.54 . . . . 0.0 111.915 -169.623 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 65.2 t -119.31 133.46 66.06 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 C-N-CA 125.122 1.369 . . . . 0.0 110.378 172.462 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 45.2 m -127.16 134.42 50.18 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 125.509 1.523 . . . . 0.0 110.473 177.767 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -84.08 138.04 33.26 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.743 1.217 . . . . 0.0 111.022 175.459 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 45.6 mt -93.73 159.19 35.24 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 124.828 1.251 . . . . 0.0 111.695 177.768 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -65.56 -4.47 9.67 Favored 'Trans proline' 0 CA--C 1.542 0.92 0 C-N-CA 123.538 2.825 . . . . 0.0 114.293 174.976 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -68.23 -13.11 62.0 Favored 'General case' 0 CA--C 1.553 1.058 0 CA-C-N 119.454 1.025 . . . . 0.0 112.948 169.825 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 93.84 -34.12 4.83 Favored Glycine 0 N--CA 1.475 1.272 0 C-N-CA 126.66 2.076 . . . . 0.0 114.889 169.327 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 31.0 ptt-85 -146.12 73.63 1.34 Allowed 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 123.967 1.842 . . . . 0.0 110.138 169.792 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -161.58 141.03 10.12 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 128.872 2.869 . . . . 0.0 106.232 -176.349 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -146.09 148.5 32.7 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 -166.696 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 -100.08 122.33 42.78 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.182 1.393 . . . . 0.0 110.135 168.462 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -105.74 105.81 16.02 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 126.653 1.981 . . . . 0.0 108.291 179.975 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.2 m -114.69 145.6 41.85 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -168.704 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 11.0 t -116.82 106.41 20.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 126.588 1.955 . . . . 0.0 106.37 167.313 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 79.4 t -68.61 127.22 30.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 174.069 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 57.4 ttm-85 53.87 68.14 0.89 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.1 1.36 . . . . 0.0 111.457 170.74 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -70.76 138.21 50.28 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.0 0.92 . . . . 0.0 112.118 -173.883 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 8.7 mpt_? -107.67 158.63 17.11 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 126.028 1.731 . . . . 0.0 109.743 175.211 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 40.1 mtp180 -56.15 -32.27 64.13 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 -172.245 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 5.0 p-10 -64.67 -18.68 65.19 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 114.998 1.481 . . . . 0.0 114.998 175.955 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -71.62 -24.78 61.94 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.085 0.857 . . . . 0.0 112.317 177.169 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 19.3 m -54.71 141.55 31.86 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.254 1.022 . . . . 0.0 112.746 -178.37 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 146.98 -163.77 28.61 Favored Glycine 0 N--CA 1.471 1.029 0 C-N-CA 124.432 1.015 . . . . 0.0 113.083 -174.414 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.3 m -92.0 141.04 29.05 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.406 1.082 . . . . 0.0 110.599 -178.308 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 33.6 m-85 -132.57 159.63 38.92 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.779 2.032 . . . . 0.0 110.942 178.818 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -166.25 155.84 11.76 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.61 1.564 . . . . 0.0 112.033 179.909 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 30.8 m -99.53 159.93 14.66 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.873 0.869 . . . . 0.0 112.036 172.86 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -148.06 122.12 1.47 Allowed Glycine 0 CA--C 1.525 0.713 0 C-N-CA 124.836 1.208 . . . . 0.0 111.954 169.668 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -91.55 156.77 17.43 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.592 0.757 . . . . 0.0 111.437 173.886 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.1 tt -152.99 133.05 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 124.453 1.101 . . . . 0.0 110.526 176.654 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 8.5 m -65.42 161.47 19.78 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.739 1.216 . . . . 0.0 113.464 -175.079 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -60.51 -21.78 62.85 Favored 'General case' 0 CA--C 1.547 0.827 0 N-CA-C 115.573 1.694 . . . . 0.0 115.573 -179.258 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -78.33 143.5 64.69 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 124.318 1.047 . . . . 0.0 112.702 -174.755 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -57.35 -25.6 66.41 Favored 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 123.556 2.837 . . . . 0.0 114.514 173.349 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -81.63 -0.79 44.08 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 125.058 1.343 . . . . 0.0 113.811 179.723 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.43 167.6 10.37 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.917 1.287 . . . . 0.0 114.164 -176.242 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -143.06 153.75 43.26 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 126.508 1.923 . . . . 0.0 108.811 179.717 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 99.1 mt -71.64 123.62 26.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 CA-C-O 121.583 0.706 . . . . 0.0 111.98 -174.793 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.92 99.13 11.91 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.801 1.64 . . . . 0.0 106.83 167.326 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -84.6 137.89 33.03 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.323 0.649 . . . . 0.0 111.187 -171.497 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 8.1 t -94.89 -175.43 3.56 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.537 1.135 . . . . 0.0 113.098 179.613 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 9.8 mp -60.94 149.7 35.64 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.347 1.859 . . . . 0.0 111.285 178.788 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -92.76 141.87 27.97 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.384 1.074 . . . . 0.0 109.808 172.155 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -147.26 164.16 34.08 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.755 1.222 . . . . 0.0 111.839 175.875 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -109.44 139.86 43.9 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.217 1.007 . . . . 0.0 112.671 -170.492 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 64.1 tp -108.48 132.15 54.1 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 125.915 1.686 . . . . 0.0 108.963 168.614 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 62.5 ttm-85 -123.83 115.92 22.11 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.754 1.622 . . . . 0.0 109.702 174.028 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 48.7 t -102.78 113.81 40.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 124.372 1.069 . . . . 0.0 108.75 172.006 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 65.0 p -93.65 146.83 23.54 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.605 1.562 . . . . 0.0 109.885 177.95 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -62.79 148.7 46.08 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 121.413 -0.804 . . . . 0.0 112.91 -175.782 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 45.8 ttt85 -78.36 119.32 21.54 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 124.047 0.939 . . . . 0.0 110.257 -173.943 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 66.6 ttp85 -71.05 138.85 50.16 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.559 0.744 . . . . 0.0 111.578 -175.439 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -81.42 149.42 28.82 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.599 1.16 . . . . 0.0 112.168 175.102 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 . . . . . 0 C--O 1.254 1.291 0 C-N-CA 125.698 1.599 . . . . 0.0 112.624 -177.211 . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 2.1 tmt? . . . . . 0 N--CA 1.489 1.477 0 CA-C-O 118.468 -0.777 . . . . 0.0 110.238 . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -81.81 133.87 8.21 Favored 'Trans proline' 0 CA--C 1.543 0.939 0 C-N-CA 123.439 2.759 . . . . 0.0 110.798 177.461 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -58.08 136.13 72.96 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 123.554 2.836 . . . . 0.0 113.124 173.228 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.8 p -137.14 156.82 47.88 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.134 1.373 . . . . 0.0 112.125 -172.603 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -146.33 120.22 9.33 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.912 1.685 . . . . 0.0 109.159 -178.159 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 80.5 p -140.97 159.37 62.25 Favored Pre-proline 0 CA--C 1.55 0.947 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -169.872 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -69.59 161.46 85.63 Favored 'Cis proline' 0 C--N 1.354 0.833 0 CA-C-N 119.551 0.875 . . . . 0.0 111.501 -6.434 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.48 -24.65 67.91 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 113.169 0.803 . . . . 0.0 113.169 176.052 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 46.7 tp -140.4 120.77 14.01 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.568 1.547 . . . . 0.0 108.761 169.854 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 55.4 tp -105.96 125.79 51.42 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.267 1.427 . . . . 0.0 109.029 170.635 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.4 t -110.27 124.39 66.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 124.082 0.953 . . . . 0.0 108.563 173.041 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.6 m -128.3 164.71 29.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 C-N-CA 124.644 1.178 . . . . 0.0 111.635 174.421 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 18.3 m -90.83 148.8 22.27 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.707 1.203 . . . . 0.0 110.437 173.962 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -53.18 123.68 12.45 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.823 1.249 . . . . 0.0 111.406 176.428 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 89.12 -1.56 82.92 Favored Glycine 0 CA--C 1.533 1.199 0 C-N-CA 125.869 1.7 . . . . 0.0 114.826 -177.298 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -86.72 156.68 19.86 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 119.597 1.698 . . . . 0.0 111.877 173.217 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -83.88 123.68 30.18 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.856 0.862 . . . . 0.0 110.294 175.682 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -101.48 129.15 47.48 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.478 1.111 . . . . 0.0 110.894 179.182 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 65.3 m -132.77 126.61 32.8 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.895 0.878 . . . . 0.0 111.533 -178.573 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -101.68 152.12 21.21 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.729 1.612 . . . . 0.0 110.812 169.747 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.6 m -100.72 126.77 47.29 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.639 1.576 . . . . 0.0 109.236 175.853 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 49.4 t -117.97 138.5 52.13 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.382 1.873 . . . . 0.0 111.124 177.561 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 74.1 m -137.55 126.93 24.82 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.528 -0.733 . . . . 0.0 110.17 176.054 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -120.63 156.16 32.26 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.707 1.603 . . . . 0.0 113.978 175.838 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.1 t -137.65 164.31 29.13 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.52 1.928 . . . . 0.0 107.853 166.85 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -156.87 157.1 34.28 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 -169.364 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 11.5 t -73.75 -32.69 63.96 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.082 1.353 . . . . 0.0 112.157 174.812 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 43.3 m -85.43 165.61 17.05 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.938 1.295 . . . . 0.0 111.912 174.485 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -71.56 -16.58 62.32 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.942 1.697 . . . . 0.0 114.287 -176.703 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 9.2 t -162.84 165.43 25.31 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.456 1.502 . . . . 0.0 111.248 178.529 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 46.1 p90 -158.32 155.5 28.91 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.453 1.501 . . . . 0.0 112.075 -173.723 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 93.8 t -95.9 125.36 48.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 125.119 1.368 . . . . 0.0 107.332 169.378 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 56.8 tp -99.95 136.94 39.11 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.978 0.911 . . . . 0.0 110.29 178.059 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 -127.25 160.29 31.74 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.397 1.479 . . . . 0.0 110.627 -176.58 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 19.0 t90 -126.38 139.79 53.0 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.075 1.35 . . . . 0.0 111.427 179.606 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -136.13 144.52 45.11 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.763 1.225 . . . . 0.0 113.749 -171.82 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 56.8 ttt85 -102.49 140.15 37.14 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.886 1.674 . . . . 0.0 107.789 167.162 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 35.4 mtp -89.64 145.94 24.89 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 118.98 0.809 . . . . 0.0 112.318 176.235 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.1 p -89.16 162.06 38.61 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 123.824 0.849 . . . . 0.0 111.991 172.141 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -67.79 -18.87 47.52 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 122.755 2.303 . . . . 0.0 112.642 172.413 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.6 m -80.8 3.99 20.58 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 124.744 1.218 . . . . 0.0 113.042 170.83 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 63.7 t30 70.97 26.38 3.6 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 127.329 2.252 . . . . 0.0 113.24 178.5 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -96.71 -172.7 2.54 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.408 1.083 . . . . 0.0 109.755 169.705 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.0 p -141.6 145.16 34.71 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.619 1.567 . . . . 0.0 110.698 -174.372 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -124.72 130.58 52.69 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 125.035 1.334 . . . . 0.0 110.776 175.821 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 37.5 tttm -83.77 119.1 24.4 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.61 1.164 . . . . 0.0 111.66 -173.134 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 57.5 mt -93.55 -49.19 6.01 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.559 1.544 . . . . 0.0 112.446 -169.278 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -166.5 176.38 7.39 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.289 1.836 . . . . 0.0 110.546 -173.798 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -158.48 163.47 37.1 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.721 1.209 . . . . 0.0 112.674 -175.142 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -137.62 122.72 12.49 Favored Pre-proline 0 CA--C 1.549 0.904 0 C-N-CA 125.569 1.548 . . . . 0.0 109.802 169.977 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -61.49 156.03 57.44 Favored 'Cis proline' 0 C--N 1.352 0.726 0 CA-C-N 120.056 1.056 . . . . 0.0 111.745 -4.251 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -61.69 109.43 1.21 Allowed 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.734 1.214 . . . . 0.0 113.327 -168.779 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -93.05 35.43 1.06 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.939 1.696 . . . . 0.0 111.517 175.268 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 40.6 ptt180 -60.05 -10.99 4.87 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.541 1.936 . . . . 0.0 115.406 -171.815 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 17.3 m -68.84 -10.06 54.8 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.445 1.498 . . . . 0.0 114.035 172.279 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -59.5 160.73 12.62 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 124.623 1.169 . . . . 0.0 112.99 173.602 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -72.59 159.5 48.71 Favored 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 122.658 2.239 . . . . 0.0 110.519 168.007 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 80.21 52.18 4.67 Favored Glycine 0 N--CA 1.47 0.958 0 C-N-CA 123.546 0.593 . . . . 0.0 111.854 179.506 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 83.7 mt-30 -83.03 57.47 3.93 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.341 1.456 . . . . 0.0 112.24 -170.19 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -81.39 118.61 22.82 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.677 1.191 . . . . 0.0 110.088 172.538 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 58.0 p -72.85 -9.19 58.4 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 -175.959 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 1.7 ptm85 -67.37 -20.6 65.59 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 -178.394 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -101.01 126.25 47.67 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.196 1.398 . . . . 0.0 110.267 179.065 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 79.3 mtm180 -134.25 149.81 50.98 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.705 1.202 . . . . 0.0 111.858 -178.24 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 46.6 t -126.5 130.98 71.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 125.112 1.365 . . . . 0.0 109.334 171.11 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 92.4 m -130.53 132.73 45.74 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.687 1.195 . . . . 0.0 110.233 -179.48 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -80.58 141.74 34.76 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.37 0.668 . . . . 0.0 111.824 173.548 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 26.4 mt -90.36 158.29 43.65 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 124.03 0.932 . . . . 0.0 111.342 173.604 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -66.73 -4.69 11.58 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 123.61 2.873 . . . . 0.0 113.97 174.814 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 23.7 m120 -64.31 -18.99 65.13 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.167 0.987 . . . . 0.0 113.428 172.439 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 95.18 -20.92 46.95 Favored Glycine 0 N--CA 1.474 1.205 0 C-N-CA 125.77 1.652 . . . . 0.0 115.392 169.715 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -154.5 73.53 0.91 Allowed 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.468 1.507 . . . . 0.0 109.914 171.288 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -170.39 136.97 1.39 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 127.707 2.403 . . . . 0.0 107.662 -171.99 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 70.8 m-85 -145.18 145.81 31.5 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.891 0.877 . . . . 0.0 112.916 -168.192 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -101.76 125.83 48.5 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.236 1.415 . . . . 0.0 111.433 169.998 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -104.91 112.96 26.28 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.819 2.048 . . . . 0.0 108.419 174.884 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 67.6 m -122.03 129.18 52.22 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 115.147 1.536 . . . . 0.0 115.147 -167.954 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 44.3 t -96.36 116.49 38.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 125.916 1.687 . . . . 0.0 107.532 168.288 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 85.7 t -78.63 125.84 38.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 124.158 0.983 . . . . 0.0 110.177 176.412 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 51.11 66.71 1.1 Allowed 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 126.218 1.807 . . . . 0.0 112.157 175.456 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.42 130.48 43.19 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.508 1.123 . . . . 0.0 111.572 -173.352 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.03 169.58 8.59 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.952 1.701 . . . . 0.0 110.274 171.706 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 27.7 mtp180 -56.29 -30.71 62.86 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 121.208 -0.932 . . . . 0.0 113.373 -177.098 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 29.7 t30 -60.43 -27.94 67.88 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 124.967 1.307 . . . . 0.0 114.387 172.299 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -75.62 -14.54 60.38 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.289 0.95 . . . . 0.0 113.086 175.536 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 34.2 m -61.63 141.34 57.86 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 120.231 1.378 . . . . 0.0 111.65 177.385 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 150.41 -169.67 30.34 Favored Glycine 0 N--CA 1.473 1.138 0 C-N-CA 124.377 0.989 . . . . 0.0 113.345 -176.997 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.3 m -94.88 142.45 27.45 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.271 1.028 . . . . 0.0 110.517 -178.057 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -138.82 162.51 34.58 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.137 1.775 . . . . 0.0 111.71 -179.144 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -161.75 157.56 24.46 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.578 1.551 . . . . 0.0 111.783 174.183 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 25.9 p -104.68 151.73 23.35 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.456 0.702 . . . . 0.0 111.754 168.834 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -148.47 133.05 4.41 Favored Glycine 0 N--CA 1.471 0.986 0 C-N-CA 124.709 1.147 . . . . 0.0 112.784 -177.836 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -110.57 156.02 21.51 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -176.175 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 19.7 tt -137.89 136.13 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 125.698 1.599 . . . . 0.0 109.921 174.026 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 14.4 t -62.77 157.52 20.97 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.774 0.83 . . . . 0.0 112.953 176.935 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.49 -9.65 50.31 Favored 'General case' 0 CA--C 1.546 0.827 0 N-CA-C 114.274 1.213 . . . . 0.0 114.274 169.95 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -68.56 149.18 98.07 Favored Pre-proline 0 CA--C 1.553 1.078 0 C-N-CA 124.341 1.056 . . . . 0.0 112.428 178.592 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -69.32 -26.13 29.93 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 122.951 2.434 . . . . 0.0 112.812 178.853 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.8 ptmt -86.04 5.22 34.51 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.218 1.407 . . . . 0.0 114.581 178.055 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.41 163.17 18.87 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.799 1.24 . . . . 0.0 114.214 -173.335 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.96 157.25 43.42 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 126.308 1.843 . . . . 0.0 108.648 176.875 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 61.7 mt -78.31 124.38 36.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 123.861 0.865 . . . . 0.0 111.269 -174.482 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 24.1 tptp -94.55 126.93 40.15 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.297 1.439 . . . . 0.0 109.613 168.839 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -84.38 157.02 21.57 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.293 1.037 . . . . 0.0 112.059 175.237 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 97.0 p -108.33 -166.13 1.1 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 125.241 1.416 . . . . 0.0 111.099 168.128 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 11.1 mp -63.16 151.02 41.41 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.347 1.059 . . . . 0.0 111.715 172.661 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -90.69 142.74 27.45 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.075 0.95 . . . . 0.0 109.985 171.542 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -135.0 152.93 52.18 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 125.322 1.449 . . . . 0.0 111.809 178.74 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -104.51 138.87 40.24 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.661 1.184 . . . . 0.0 111.687 -177.9 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 50.9 tp -108.81 129.28 55.39 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 125.905 1.682 . . . . 0.0 109.202 169.348 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 60.6 ttt85 -121.69 120.22 34.07 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.795 1.638 . . . . 0.0 109.71 173.664 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 39.1 t -104.22 118.91 52.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 124.177 0.991 . . . . 0.0 109.045 171.626 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 67.4 p -98.74 154.77 17.74 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 126.114 1.766 . . . . 0.0 110.459 178.266 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -65.85 144.78 56.61 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.674 -0.641 . . . . 0.0 112.21 -177.367 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 35.9 ttt85 -84.34 133.25 34.54 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.577 1.151 . . . . 0.0 109.862 179.169 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 -127.95 153.76 46.34 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.662 1.185 . . . . 0.0 111.669 -177.189 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -74.54 154.37 38.65 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.552 1.141 . . . . 0.0 112.363 174.415 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 . . . . . 0 C--O 1.253 1.258 0 C-N-CA 125.045 1.338 . . . . 0.0 113.277 176.131 . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 2.3 mpt? . . . . . 0 N--CA 1.488 1.446 0 CA-C-O 118.356 -0.83 . . . . 0.0 110.492 . . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -60.5 149.91 84.15 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 123.535 2.824 . . . . 0.0 112.096 173.229 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -71.13 115.49 4.29 Favored 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 123.743 2.962 . . . . 0.0 110.436 178.924 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.7 t -152.23 156.9 40.63 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.577 0.751 . . . . 0.0 112.802 -170.535 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 82.9 t80 -149.05 117.46 6.49 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.593 2.357 . . . . 0.0 108.647 -176.603 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 91.8 p -140.96 159.35 62.36 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 124.554 1.142 . . . . 0.0 113.558 -169.032 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -70.35 164.98 79.55 Favored 'Cis proline' 0 C--N 1.355 0.893 0 CA-C-N 119.987 1.031 . . . . 0.0 112.221 -2.535 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.05 -24.94 68.15 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 175.573 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 40.2 tp -143.55 119.03 10.32 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 125.772 1.629 . . . . 0.0 108.855 169.847 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 56.6 tp -102.1 124.39 47.63 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.656 1.182 . . . . 0.0 108.859 169.536 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.8 t -110.17 124.51 66.98 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 172.756 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 30.5 m -126.06 163.56 27.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 C-N-CA 124.388 1.075 . . . . 0.0 111.781 172.398 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 35.1 m -92.53 144.95 24.83 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.031 0.932 . . . . 0.0 109.863 171.836 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -49.65 124.59 9.86 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.333 1.453 . . . . 0.0 112.579 -179.262 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 91.52 -3.89 79.26 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 126.052 1.787 . . . . 0.0 114.818 -177.415 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -84.75 157.64 20.97 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.585 1.692 . . . . 0.0 112.088 174.929 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -83.61 117.65 23.3 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.84 0.856 . . . . 0.0 110.478 175.64 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -97.83 114.46 26.51 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.152 0.981 . . . . 0.0 111.134 -177.3 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 30.5 m -117.56 126.5 52.68 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.758 0.823 . . . . 0.0 111.793 -177.164 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -100.89 159.51 15.14 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.527 1.931 . . . . 0.0 109.969 169.385 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 93.3 m -102.36 139.16 38.33 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.346 1.458 . . . . 0.0 108.699 169.669 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 46.8 t -130.35 146.33 51.92 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.707 1.203 . . . . 0.0 111.234 171.062 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 16.0 t -149.54 133.62 17.18 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 121.347 -0.846 . . . . 0.0 111.342 179.044 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 18.5 m-85 -140.95 156.17 46.12 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 127.779 2.432 . . . . 0.0 111.69 -179.103 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 35.3 m -135.97 111.28 9.07 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.13 0.972 . . . . 0.0 110.54 168.44 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 52.8 m-80 -95.21 164.26 12.93 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.462 1.105 . . . . 0.0 111.014 172.545 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 19.9 m -65.01 -38.5 91.12 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.391 1.477 . . . . 0.0 111.423 177.968 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 33.5 m -71.28 147.01 48.57 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.857 1.263 . . . . 0.0 110.442 169.407 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -65.36 -32.4 74.02 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.47 1.108 . . . . 0.0 112.447 -178.353 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 66.7 m -123.8 158.58 31.46 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.41 1.484 . . . . 0.0 111.664 174.407 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 44.9 p90 -160.69 165.28 30.79 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.467 1.507 . . . . 0.0 111.437 -174.418 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 22.4 t -96.0 128.04 47.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 171.05 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 18.8 tp -105.12 139.11 40.28 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.911 0.884 . . . . 0.0 110.072 171.726 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 14.8 m-80 -132.94 150.38 52.16 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.582 1.553 . . . . 0.0 110.644 -169.698 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 9.4 t90 -121.71 137.55 54.71 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.201 1.0 . . . . 0.0 111.758 -178.493 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -134.07 144.32 48.56 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.565 1.146 . . . . 0.0 113.155 -175.434 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -104.89 140.08 38.68 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.028 1.331 . . . . 0.0 108.438 168.251 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 27.2 mtp -87.12 141.82 28.38 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 118.717 0.69 . . . . 0.0 111.956 178.879 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 50.2 m -92.81 157.98 38.64 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 124.888 1.275 . . . . 0.0 111.919 176.562 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_exo -55.73 -33.8 88.82 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 123.919 3.079 . . . . 0.0 114.113 176.48 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.7 m -77.03 9.55 2.91 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.182 1.393 . . . . 0.0 113.768 176.932 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 26.8 m120 70.42 20.9 5.85 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 127.336 2.254 . . . . 0.0 113.359 -179.016 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -89.99 -173.73 3.98 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.482 1.113 . . . . 0.0 110.549 170.555 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.9 p -144.15 145.93 32.43 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.779 1.632 . . . . 0.0 110.507 -175.635 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -123.15 132.4 54.06 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.648 1.179 . . . . 0.0 111.192 175.243 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -79.01 126.87 31.26 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.921 0.888 . . . . 0.0 111.382 -177.892 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 59.4 mt -99.75 -45.15 5.84 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.984 1.313 . . . . 0.0 112.472 -169.968 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -173.99 175.9 2.69 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.713 2.405 . . . . 0.0 110.282 -174.102 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.55 168.83 25.19 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.206 1.403 . . . . 0.0 112.379 -178.544 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -144.66 122.29 6.53 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 125.64 1.576 . . . . 0.0 110.042 169.481 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -51.59 145.72 10.07 Favored 'Cis proline' 0 C--N 1.352 0.759 0 CA-C-N 120.435 1.191 . . . . 0.0 112.582 -9.319 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -70.14 117.57 11.86 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 122.441 1.115 . . . . 0.0 113.696 -168.378 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -94.53 9.64 37.79 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.826 2.051 . . . . 0.0 112.284 177.938 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -56.88 -6.07 0.3 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 128.229 2.611 . . . . 0.0 117.012 -169.904 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 12.9 p -74.73 -20.45 59.83 Favored 'General case' 0 CA--C 1.546 0.822 0 O-C-N 120.987 -1.071 . . . . 0.0 112.897 169.078 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -84.41 144.79 43.89 Favored Pre-proline 0 CA--C 1.547 0.83 0 C-N-CA 124.576 1.15 . . . . 0.0 110.597 174.615 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -73.85 156.14 48.36 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 124.022 3.148 . . . . 0.0 113.853 -168.371 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 100.86 -24.88 30.37 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 126.337 1.923 . . . . 0.0 111.57 -178.115 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -82.57 148.22 28.16 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.936 1.294 . . . . 0.0 111.553 -178.707 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -143.0 142.38 31.59 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.588 1.155 . . . . 0.0 112.519 -174.677 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 15.4 m -65.72 -15.5 62.88 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 115.571 1.693 . . . . 0.0 115.571 -172.072 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 44.5 mtp-105 -65.97 -28.84 69.2 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.55 1.068 . . . . 0.0 112.14 171.884 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -92.03 127.88 37.67 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.922 1.289 . . . . 0.0 109.736 175.625 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -131.15 144.16 51.17 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.19 1.396 . . . . 0.0 110.804 -175.867 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 47.8 t -126.57 128.28 71.05 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 124.846 1.258 . . . . 0.0 108.986 176.478 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 88.5 m -125.98 132.31 52.07 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.82 1.248 . . . . 0.0 110.287 -176.939 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -88.13 137.94 31.88 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.024 0.929 . . . . 0.0 110.407 172.735 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 44.2 mt -87.47 158.7 51.31 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 124.745 1.218 . . . . 0.0 111.433 177.669 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -65.42 -2.71 6.46 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 123.529 2.819 . . . . 0.0 114.293 175.85 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -63.52 -26.08 68.54 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 119.643 1.11 . . . . 0.0 112.861 169.735 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 98.61 -22.22 42.05 Favored Glycine 0 N--CA 1.476 1.308 0 C-N-CA 125.696 1.617 . . . . 0.0 114.273 174.579 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -154.48 73.65 0.92 Allowed 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.519 1.528 . . . . 0.0 110.166 169.381 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 17.9 t0 -163.56 141.48 7.6 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 128.919 2.888 . . . . 0.0 106.819 178.486 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -146.42 155.75 42.8 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 -167.188 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 56.7 m170 -116.15 147.61 41.19 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 126.043 1.737 . . . . 0.0 110.955 168.502 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 33.3 mtt -132.94 112.96 12.3 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.622 1.569 . . . . 0.0 109.381 -178.009 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 68.0 m -118.41 126.21 51.59 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 -167.561 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 19.7 t -90.53 108.35 19.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 167.653 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 88.7 t -70.55 125.74 29.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 123.727 0.811 . . . . 0.0 109.389 176.325 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 39.2 ttm180 54.64 63.83 2.01 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.108 1.363 . . . . 0.0 111.035 172.241 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -70.38 137.36 50.44 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.554 0.742 . . . . 0.0 111.476 -171.427 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -114.66 163.44 15.44 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.818 1.647 . . . . 0.0 110.62 -179.542 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 88.1 mtm-85 -52.88 -34.96 57.08 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.867 0.867 . . . . 0.0 112.858 -175.501 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 39.5 t30 -66.13 -16.42 63.94 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.857 1.663 . . . . 0.0 115.238 176.216 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -80.28 -14.1 58.66 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 120.305 1.411 . . . . 0.0 112.989 176.312 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 20.2 m -62.74 138.79 58.6 Favored 'General case' 0 CA--C 1.546 0.806 0 O-C-N 121.015 -1.053 . . . . 0.0 112.706 -177.543 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 150.74 -163.87 29.77 Favored Glycine 0 N--CA 1.472 1.059 0 C-N-CA 124.505 1.05 . . . . 0.0 113.293 -177.762 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.8 m -92.53 138.89 31.12 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.484 1.114 . . . . 0.0 111.277 -177.213 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -134.24 160.43 37.89 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.43 1.892 . . . . 0.0 111.395 178.218 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -157.24 158.13 35.59 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.864 1.266 . . . . 0.0 112.64 173.096 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 45.5 t -109.41 147.61 32.51 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.865 1.666 . . . . 0.0 111.033 -178.68 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -150.66 142.13 9.32 Favored Glycine 0 N--CA 1.471 0.997 0 N-CA-C 114.63 0.612 . . . . 0.0 114.63 179.272 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -115.82 159.25 21.73 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.14 1.376 . . . . 0.0 113.684 -173.933 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 19.9 tt -155.95 136.36 4.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 125.723 1.609 . . . . 0.0 110.568 173.848 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 18.2 m -65.81 161.31 21.25 Favored 'General case' 0 N--CA 1.475 0.787 0 O-C-N 121.282 -0.886 . . . . 0.0 113.115 179.927 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 56.6 mt -70.06 -20.6 63.22 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.731 1.012 . . . . 0.0 113.731 -177.882 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -70.37 146.09 93.87 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 124.35 1.06 . . . . 0.0 112.253 177.4 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -69.65 -16.6 38.1 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 123.296 2.664 . . . . 0.0 113.273 -179.653 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 47.5 mmtm -79.95 -0.27 34.44 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.78 1.232 . . . . 0.0 114.142 177.114 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -77.05 165.22 24.91 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 125.633 1.573 . . . . 0.0 113.78 -178.093 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 27.4 mp0 -138.59 155.83 48.0 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.902 1.681 . . . . 0.0 109.719 174.262 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 32.0 mm -60.48 137.11 23.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 124.421 1.088 . . . . 0.0 111.158 177.879 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.12 137.2 54.91 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.983 1.713 . . . . 0.0 109.54 169.585 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -113.94 153.7 28.83 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.27 1.028 . . . . 0.0 112.863 -169.424 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 80.2 p -104.44 173.31 6.36 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.655 1.582 . . . . 0.0 112.914 174.717 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.83 122.81 18.51 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.532 1.133 . . . . 0.0 110.88 174.416 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.73 151.26 45.59 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.14 0.976 . . . . 0.0 113.227 179.662 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -143.0 164.81 29.06 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.52 1.528 . . . . 0.0 112.913 -178.486 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -102.78 143.13 32.81 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.267 1.427 . . . . 0.0 112.834 -172.737 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 60.7 tp -114.79 132.13 56.57 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 126.343 1.857 . . . . 0.0 108.542 168.075 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 61.9 ttm-85 -126.01 120.22 29.72 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.284 1.433 . . . . 0.0 109.908 174.098 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 41.2 t -104.36 113.09 40.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 124.355 1.062 . . . . 0.0 108.623 170.507 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 71.2 p -93.01 145.31 24.47 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.342 1.457 . . . . 0.0 109.858 178.925 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -66.64 144.91 56.11 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 121.431 0.634 . . . . 0.0 111.959 -178.212 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 55.8 ttm-85 -84.68 121.44 27.67 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 123.878 0.871 . . . . 0.0 110.337 -176.622 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -72.27 161.67 30.53 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.054 0.942 . . . . 0.0 113.402 -178.714 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -74.95 154.41 38.14 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.421 1.088 . . . . 0.0 110.5 167.788 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 . . . . . 0 N--CA 1.483 1.207 0 C-N-CA 126.845 2.058 . . . . 0.0 115.561 177.869 . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 25.2 ptp . . . . . 0 N--CA 1.489 1.479 0 CA-C-O 118.404 -0.807 . . . . 0.0 111.151 . . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -75.59 158.9 39.68 Favored 'Trans proline' 0 CA--C 1.542 0.92 0 C-N-CA 123.343 2.695 . . . . 0.0 111.115 174.356 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -67.96 114.95 3.55 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 123.558 2.839 . . . . 0.0 109.684 174.586 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 27.5 m -134.65 147.96 50.26 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 126.993 2.117 . . . . 0.0 109.117 -172.312 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 43.9 t80 -149.01 121.39 8.45 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.677 1.191 . . . . 0.0 110.484 -176.576 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 58.7 m -140.87 159.89 60.53 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 124.489 1.115 . . . . 0.0 113.026 -169.344 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -70.02 158.85 91.37 Favored 'Cis proline' 0 C--N 1.353 0.807 0 CA-C-N 119.88 0.993 . . . . 0.0 111.482 -5.168 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.56 -30.99 69.02 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 174.476 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 33.4 tp -134.93 123.08 22.83 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 125.44 1.496 . . . . 0.0 108.932 170.403 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 54.7 tp -108.37 124.84 50.99 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.736 1.214 . . . . 0.0 109.256 170.524 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 18.8 t -109.76 124.31 66.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 C-N-CA 123.935 0.894 . . . . 0.0 108.898 173.566 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.6 m -127.64 169.83 18.43 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 C-N-CA 124.897 1.279 . . . . 0.0 111.355 171.924 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 89.5 m -100.0 147.86 25.15 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.771 1.229 . . . . 0.0 110.244 174.757 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -55.32 119.1 5.06 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.676 1.19 . . . . 0.0 112.159 179.808 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.87 -1.16 63.16 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 126.301 1.905 . . . . 0.0 114.709 -176.911 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -90.93 153.73 19.98 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 119.275 1.538 . . . . 0.0 110.924 171.245 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -80.79 139.91 35.77 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 121.875 0.845 . . . . 0.0 111.519 171.919 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -114.65 130.27 56.78 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.246 1.818 . . . . 0.0 110.545 -178.664 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 30.9 m -132.7 124.6 28.49 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.71 0.804 . . . . 0.0 111.618 -176.552 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -101.59 159.57 15.19 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.032 1.733 . . . . 0.0 110.299 169.469 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 25.9 m -112.66 132.02 55.37 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.368 1.467 . . . . 0.0 110.067 175.057 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 35.3 t -114.39 140.82 48.36 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.572 1.549 . . . . 0.0 112.08 171.899 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 17.2 m -134.13 131.85 39.19 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.967 1.707 . . . . 0.0 108.305 176.036 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 42.4 p90 -160.69 156.18 25.07 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 119.919 1.236 . . . . 0.0 113.558 -169.179 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.5 p -83.45 147.69 27.69 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.746 1.218 . . . . 0.0 113.109 173.876 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -163.73 160.32 22.44 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.159 2.184 . . . . 0.0 110.262 174.418 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 80.6 p -68.27 175.25 3.39 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 124.115 0.966 . . . . 0.0 112.932 -173.505 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 20.2 m -70.94 -8.23 51.58 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 172.861 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -93.5 -79.24 0.41 Allowed 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.74 1.216 . . . . 0.0 111.672 -176.015 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.5 t -173.28 167.16 4.82 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.164 1.386 . . . . 0.0 111.396 -169.876 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 55.9 p90 -160.56 163.0 33.07 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.05 1.34 . . . . 0.0 113.501 -170.156 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 62.4 t -107.14 124.2 62.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 125.5 1.52 . . . . 0.0 107.08 167.681 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -99.4 140.78 33.07 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.454 1.502 . . . . 0.0 108.014 170.701 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 31.4 m120 -136.68 149.42 47.91 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.502 1.521 . . . . 0.0 111.171 175.331 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 22.0 t90 -124.55 138.36 54.33 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.525 1.13 . . . . 0.0 110.73 174.602 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -132.47 147.94 52.38 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 -170.939 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.9 ttt180 -109.26 141.34 41.69 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.792 1.637 . . . . 0.0 108.355 167.242 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 36.2 mtp -86.42 145.89 26.66 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 118.944 0.793 . . . . 0.0 112.462 176.301 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.1 p -88.88 165.2 28.34 Favored Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 123.89 0.876 . . . . 0.0 112.662 174.162 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -58.82 -28.98 88.65 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 123.636 2.891 . . . . 0.0 113.433 170.594 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.4 m -80.36 1.78 27.49 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.896 1.279 . . . . 0.0 113.265 175.939 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 73.61 21.09 2.92 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 127.588 2.355 . . . . 0.0 113.213 -179.649 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -88.38 -172.67 3.87 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.622 0.769 . . . . 0.0 109.575 169.483 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.3 p -140.59 142.86 35.04 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.376 1.47 . . . . 0.0 110.804 -174.84 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -122.86 131.53 53.79 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.505 1.122 . . . . 0.0 110.922 175.442 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 20.8 ttmt -71.9 137.74 47.65 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.873 0.869 . . . . 0.0 110.632 178.385 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 52.8 mt -114.61 -45.99 2.98 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.936 1.695 . . . . 0.0 111.975 -171.944 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -156.51 168.62 26.82 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 126.281 1.832 . . . . 0.0 109.689 179.683 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -156.62 163.68 39.05 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.348 1.059 . . . . 0.0 111.955 -174.801 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -149.2 110.35 3.46 Favored Pre-proline 0 CA--C 1.547 0.835 0 CA-C-O 118.024 -0.988 . . . . 0.0 110.676 174.646 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -51.64 143.82 9.4 Favored 'Cis proline' 0 C--N 1.352 0.734 0 CA-C-N 120.64 1.264 . . . . 0.0 113.623 -4.794 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -75.73 135.1 40.35 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.386 1.075 . . . . 0.0 113.754 -169.239 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 37.2 t0 -104.68 36.29 2.47 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 126.297 1.839 . . . . 0.0 112.374 -168.551 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 45.3 mmm-85 -61.83 -21.95 65.07 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 125.314 1.446 . . . . 0.0 114.74 -170.226 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 16.4 p -78.75 -14.33 59.34 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 113.688 0.996 . . . . 0.0 113.688 177.545 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -98.53 155.36 36.89 Favored Pre-proline 0 CA--C 1.545 0.786 0 C-N-CA 125.036 1.334 . . . . 0.0 110.672 174.531 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -72.55 149.51 49.7 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 123.382 2.721 . . . . 0.0 111.872 -176.337 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 102.41 -21.01 42.62 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 125.643 1.592 . . . . 0.0 112.274 -177.665 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -87.14 73.75 9.73 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 122.312 1.053 . . . . 0.0 111.524 -179.374 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -83.83 145.75 28.49 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.82 1.648 . . . . 0.0 111.789 174.865 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 40.7 m -67.07 -12.87 61.15 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 -171.925 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 44.6 mtp180 -66.54 -27.03 67.43 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.18 0.9 . . . . 0.0 112.627 171.042 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 -95.01 137.48 34.0 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.937 1.295 . . . . 0.0 111.079 178.43 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 30.0 ttp180 -144.46 151.61 39.43 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.234 1.014 . . . . 0.0 111.925 177.421 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -122.79 133.83 67.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 124.962 1.305 . . . . 0.0 110.753 168.869 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.1 m -130.5 130.01 43.63 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.098 1.359 . . . . 0.0 109.871 -173.247 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -79.4 136.38 36.95 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 118.736 0.698 . . . . 0.0 110.778 178.549 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 7.0 mt -79.79 159.9 70.39 Favored Pre-proline 0 CA--C 1.544 0.715 0 CA-C-O 118.92 -0.562 . . . . 0.0 111.652 177.773 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -62.85 -16.74 55.65 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 123.135 2.556 . . . . 0.0 113.646 170.996 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -66.11 -26.06 67.28 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 119.231 0.923 . . . . 0.0 112.439 169.793 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 86.21 -34.11 3.49 Favored Glycine 0 N--CA 1.472 1.066 0 C-N-CA 126.836 2.16 . . . . 0.0 114.393 169.881 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 -111.53 73.65 0.83 Allowed 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.594 1.158 . . . . 0.0 108.194 169.41 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 175.36 141.3 0.05 Allowed 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 128.388 2.675 . . . . 0.0 109.739 -170.606 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -142.33 150.22 40.48 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.453 1.101 . . . . 0.0 112.37 178.931 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 18.2 m170 -98.82 139.24 34.79 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.329 1.452 . . . . 0.0 110.229 167.003 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -115.11 113.07 23.52 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 126.761 2.024 . . . . 0.0 108.058 175.961 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 17.8 m -118.76 128.44 54.49 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 114.331 1.234 . . . . 0.0 114.331 -167.338 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 36.6 t -99.24 117.56 44.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 125.869 1.668 . . . . 0.0 106.947 167.528 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 97.2 t -83.09 126.33 40.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 123.893 0.877 . . . . 0.0 109.96 174.577 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 85.5 mtt85 54.21 66.55 1.2 Allowed 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 126.11 1.764 . . . . 0.0 111.624 176.963 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.96 136.43 53.92 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.487 1.115 . . . . 0.0 111.308 -176.87 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -118.26 165.64 13.57 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 126.9 2.08 . . . . 0.0 110.462 -178.262 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 26.3 mmm180 -52.52 -28.73 21.83 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.348 1.059 . . . . 0.0 113.054 178.231 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -63.66 -24.22 67.7 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 125.66 1.584 . . . . 0.0 114.825 173.228 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -86.08 -17.88 33.9 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 120.147 1.34 . . . . 0.0 113.682 -176.992 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 49.3 m -57.71 133.86 55.72 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 120.779 -1.2 . . . . 0.0 112.681 -178.742 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 153.39 -167.46 31.91 Favored Glycine 0 N--CA 1.473 1.152 0 C-N-CA 124.253 0.93 . . . . 0.0 113.788 -176.073 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.2 m -91.1 143.05 27.1 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 125.162 1.385 . . . . 0.0 110.825 -175.861 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -139.94 157.55 45.5 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 126.462 1.905 . . . . 0.0 111.551 -177.796 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -156.94 149.31 23.18 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.324 1.05 . . . . 0.0 113.269 173.011 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 44.3 t -89.63 152.98 21.1 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.35 1.86 . . . . 0.0 110.884 172.057 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -160.05 141.63 7.6 Favored Glycine 0 N--CA 1.47 0.936 0 O-C-N 121.469 -0.769 . . . . 0.0 113.207 170.214 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -138.13 158.59 44.01 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 118.259 1.029 . . . . 0.0 113.154 -177.419 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 16.7 tt -147.27 134.62 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 C-N-CA 125.364 1.466 . . . . 0.0 110.097 -178.951 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 65.7 m -76.17 158.48 31.65 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 121.62 -0.675 . . . . 0.0 111.795 176.994 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 28.3 mt -73.92 -10.01 59.22 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 -177.264 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.81 143.06 94.53 Favored Pre-proline 0 CA--C 1.551 1.012 0 C-N-CA 124.104 0.962 . . . . 0.0 111.816 173.738 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -67.72 -19.83 47.05 Favored 'Trans proline' 0 CA--C 1.538 0.675 0 C-N-CA 123.313 2.676 . . . . 0.0 113.35 -176.943 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 23.3 ttpp -83.7 -0.39 50.56 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 124.92 1.288 . . . . 0.0 113.572 177.459 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -74.87 149.75 39.43 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.364 1.066 . . . . 0.0 113.39 -178.277 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -128.89 158.29 39.19 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.925 2.09 . . . . 0.0 107.764 169.991 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 35.1 mt -70.94 114.9 9.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 O-C-N 121.487 -0.758 . . . . 0.0 110.43 -179.072 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -77.85 88.51 4.06 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.32 1.448 . . . . 0.0 108.792 169.629 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -78.65 133.71 37.21 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.129 0.972 . . . . 0.0 110.394 176.898 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 45.0 m -83.68 175.53 9.64 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.396 1.078 . . . . 0.0 113.225 179.669 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 84.5 mt -58.56 147.49 32.03 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.188 0.995 . . . . 0.0 111.563 171.682 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -75.51 132.29 40.65 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 123.369 0.668 . . . . 0.0 110.561 173.839 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.9 169.65 9.07 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 126.268 1.827 . . . . 0.0 109.877 170.06 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -133.98 145.09 49.19 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 122.027 0.917 . . . . 0.0 113.021 173.271 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 68.0 tp -103.66 135.11 45.85 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 127.081 2.152 . . . . 0.0 109.687 176.233 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 60.7 ttt85 -125.27 118.09 25.22 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.731 1.612 . . . . 0.0 109.858 172.425 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 53.2 t -98.4 118.81 45.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 C-N-CA 124.062 0.945 . . . . 0.0 108.573 169.057 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 81.7 p -91.53 149.81 21.5 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.411 1.485 . . . . 0.0 109.999 173.438 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -63.16 147.09 51.87 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.276 0.56 . . . . 0.0 112.035 -179.028 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 27.5 ttm180 -70.39 121.33 17.5 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 123.805 0.842 . . . . 0.0 109.93 -176.072 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 67.2 mtt85 -80.64 154.58 27.29 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.065 0.946 . . . . 0.0 112.401 -169.322 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -73.4 154.34 40.06 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.579 1.152 . . . . 0.0 112.508 175.406 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 . . . . . 0 N--CA 1.486 1.367 0 C-N-CA 129.463 3.105 . . . . 0.0 113.236 177.352 . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 24.2 ptt? . . . . . 0 N--CA 1.49 1.551 0 CA-C-O 118.53 -0.748 . . . . 0.0 111.467 . . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_exo -59.29 146.24 95.34 Favored 'Trans proline' 0 CA--C 1.541 0.856 0 C-N-CA 123.161 2.574 . . . . 0.0 111.853 172.096 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -74.68 145.74 33.17 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 123.035 2.49 . . . . 0.0 110.991 176.319 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 32.1 p -154.62 144.93 22.03 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 125.681 1.592 . . . . 0.0 110.994 -179.945 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -121.86 135.67 54.9 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.004 1.322 . . . . 0.0 110.557 175.328 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 95.1 p -140.98 159.04 63.48 Favored Pre-proline 0 CA--C 1.549 0.921 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 173.31 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -72.7 163.72 88.0 Favored 'Cis proline' 0 C--N 1.352 0.737 0 CA-C-N 119.186 0.745 . . . . 0.0 111.411 -11.376 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.7 -33.9 74.82 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 170.432 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 51.7 tp -138.93 123.57 18.53 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.594 1.557 . . . . 0.0 109.269 171.563 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 51.6 tp -105.14 130.78 53.23 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.259 1.424 . . . . 0.0 109.341 170.755 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.4 t -112.06 126.55 69.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.987 0.915 . . . . 0.0 108.658 170.607 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.3 m -129.56 165.98 28.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 124.545 1.138 . . . . 0.0 111.933 173.079 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 20.0 m -86.3 146.5 26.48 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.178 0.991 . . . . 0.0 110.138 169.573 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 58.1 tt0 -55.32 123.59 14.3 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.042 1.337 . . . . 0.0 110.799 173.02 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.0 -0.5 72.77 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 125.5 1.524 . . . . 0.0 114.861 -174.334 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -95.43 158.08 15.61 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 119.644 1.722 . . . . 0.0 112.274 174.522 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 -83.11 116.58 22.39 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.073 0.949 . . . . 0.0 110.747 -179.866 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -98.47 116.12 30.01 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.292 1.037 . . . . 0.0 111.147 -179.793 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 57.1 m -125.28 125.45 43.55 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 118.718 0.69 . . . . 0.0 111.896 -174.609 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -101.06 146.72 27.07 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 126.371 1.868 . . . . 0.0 110.689 171.989 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 31.5 m -93.95 129.34 40.45 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.042 1.337 . . . . 0.0 108.813 171.199 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 69.8 m -130.3 130.24 44.25 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.398 1.079 . . . . 0.0 110.654 172.252 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 68.5 m -117.44 143.4 46.05 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.339 1.456 . . . . 0.0 110.687 -176.316 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -149.59 156.22 41.57 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.248 1.419 . . . . 0.0 113.475 -172.841 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.6 m -143.57 133.97 24.71 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.291 1.436 . . . . 0.0 109.834 167.734 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -143.96 166.1 25.89 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.017 1.327 . . . . 0.0 112.324 -177.428 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 25.0 p -73.1 169.62 16.63 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 127.004 2.122 . . . . 0.0 112.219 177.525 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 49.3 m 66.96 10.59 7.78 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 125.565 1.546 . . . . 0.0 114.908 169.242 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 70.29 -0.76 2.71 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 127.725 2.41 . . . . 0.0 114.041 175.621 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 22.8 t -161.17 150.29 16.52 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.592 1.557 . . . . 0.0 111.247 -175.606 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 50.3 p90 -160.17 163.01 34.0 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.505 1.522 . . . . 0.0 111.461 -169.324 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 77.4 t -95.93 127.98 47.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 172.263 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 61.3 tp -106.54 136.16 46.79 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 125.217 1.407 . . . . 0.0 109.751 173.618 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -132.43 153.8 50.48 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.282 1.833 . . . . 0.0 110.528 179.151 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 15.0 t90 -123.52 139.82 53.63 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.659 1.184 . . . . 0.0 111.118 176.081 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 64.4 m-85 -134.28 143.7 47.91 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 114.516 1.302 . . . . 0.0 114.516 -170.824 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 56.9 ttt85 -102.19 143.01 32.53 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.575 1.55 . . . . 0.0 109.229 168.406 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 86.3 mmm -77.46 133.04 38.71 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 118.466 0.575 . . . . 0.0 111.463 174.319 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.5 p -82.45 166.22 37.73 Favored Pre-proline 0 CA--C 1.549 0.914 0 O-C-N 121.557 -0.715 . . . . 0.0 112.555 173.669 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -58.32 -27.99 83.08 Favored 'Trans proline' 0 C--N 1.354 0.856 0 C-N-CA 123.475 2.784 . . . . 0.0 113.662 170.267 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 31.3 m -83.92 2.94 36.21 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.985 1.314 . . . . 0.0 113.189 175.424 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 69.55 26.68 5.02 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 126.721 2.008 . . . . 0.0 112.639 -178.758 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -92.23 -177.47 4.67 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.083 0.953 . . . . 0.0 109.743 169.606 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 8.7 p -127.48 122.51 33.64 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.574 1.55 . . . . 0.0 109.582 -171.981 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -108.22 126.35 52.7 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 124.288 1.035 . . . . 0.0 110.976 -178.094 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -79.22 120.53 23.84 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.632 1.173 . . . . 0.0 111.98 -170.809 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 42.4 mt -97.88 -49.38 4.82 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.654 1.582 . . . . 0.0 111.991 -170.139 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -162.56 169.17 20.68 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.438 1.895 . . . . 0.0 110.145 -173.12 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -157.22 162.65 39.27 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.451 1.101 . . . . 0.0 112.928 -170.155 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -152.32 113.5 2.85 Favored Pre-proline 0 CA--C 1.552 1.038 0 C-N-CA 125.379 1.472 . . . . 0.0 111.114 174.547 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -63.04 160.96 57.85 Favored 'Cis proline' 0 CA--C 1.538 0.686 0 CA-C-N 119.653 0.912 . . . . 0.0 110.287 -12.041 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -74.57 94.6 2.67 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.833 0.825 . . . . 0.0 111.419 -178.233 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -88.91 -0.85 57.75 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.927 1.691 . . . . 0.0 113.773 -179.251 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 50.1 ptt85 -64.09 -35.22 80.04 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.958 1.703 . . . . 0.0 114.217 -173.424 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.0 m 66.44 -45.12 0.43 Allowed 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 128.342 2.657 . . . . 0.0 114.671 -177.048 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 26.0 tp60 -90.0 140.9 27.65 Favored Pre-proline 0 CA--C 1.548 0.873 0 C-N-CA 126.061 1.744 . . . . 0.0 111.085 -176.548 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -89.21 -179.47 2.05 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 124.986 3.791 . . . . 0.0 112.023 175.047 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 112.72 -0.19 26.0 Favored Glycine 0 N--CA 1.471 1.022 0 C-N-CA 125.022 1.296 . . . . 0.0 114.331 173.534 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 22.3 mp0 -76.21 156.67 33.39 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.551 1.14 . . . . 0.0 111.286 175.748 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -68.1 126.81 30.7 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.281 1.032 . . . . 0.0 111.851 178.335 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 16.1 m -68.95 -12.76 61.95 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 -172.877 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 60.6 mtm-85 -65.26 -44.49 87.9 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.649 1.18 . . . . 0.0 112.574 -179.427 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 84.4 m-85 -69.48 130.68 43.16 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.473 1.509 . . . . 0.0 112.026 -179.045 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 31.8 ttp-105 -144.39 141.29 29.57 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 126.041 1.737 . . . . 0.0 111.079 -176.841 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 57.9 t -108.46 127.81 64.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 C-N-CA 125.089 1.356 . . . . 0.0 108.678 169.502 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 6.0 m -123.32 138.65 54.57 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.633 1.573 . . . . 0.0 109.428 -176.323 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.16 141.79 34.44 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.108 0.963 . . . . 0.0 112.679 179.373 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -96.76 158.72 33.08 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 126.079 1.752 . . . . 0.0 111.169 -174.75 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -66.98 -11.28 31.64 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 123.627 2.884 . . . . 0.0 114.224 -178.993 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -66.56 -18.25 65.26 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 119.197 0.908 . . . . 0.0 113.248 172.203 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 88.83 -14.69 59.57 Favored Glycine 0 CA--C 1.535 1.3 0 C-N-CA 125.496 1.522 . . . . 0.0 115.323 175.492 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.4 ptp180 -154.51 73.53 0.91 Allowed 'General case' 0 N--CA 1.473 0.694 0 CA-C-O 122.972 1.367 . . . . 0.0 110.581 171.585 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -165.04 143.87 6.59 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 129.254 3.022 . . . . 0.0 106.684 -179.657 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -145.32 145.2 31.13 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -167.54 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 7.3 m-70 -109.1 117.6 34.58 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.539 1.536 . . . . 0.0 110.859 170.118 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -100.47 111.16 23.38 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 125.768 1.627 . . . . 0.0 108.206 177.855 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 13.6 t -120.12 130.09 54.46 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 -168.061 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 12.1 t -97.45 100.25 10.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 125.696 1.598 . . . . 0.0 107.045 168.444 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 95.4 t -66.83 130.8 32.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 123.662 0.785 . . . . 0.0 109.907 178.191 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . 0.265 14.6 ptm180 39.7 61.16 1.48 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 127.516 2.326 . . . . 0.0 113.94 -177.123 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.76 140.01 57.71 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.403 1.481 . . . . 0.0 112.605 -171.731 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -104.61 162.02 13.63 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.355 1.462 . . . . 0.0 110.866 -179.478 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 16.4 mmm180 -47.48 -41.12 20.0 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.471 1.108 . . . . 0.0 113.015 178.043 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -65.27 -21.56 66.74 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 125.349 1.46 . . . . 0.0 114.832 177.657 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -75.8 -12.24 60.13 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 119.133 0.879 . . . . 0.0 112.532 176.993 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.5 m -59.09 139.53 56.78 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 120.634 -1.291 . . . . 0.0 111.609 171.794 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 154.76 -168.28 32.79 Favored Glycine 0 N--CA 1.468 0.771 0 C-N-CA 123.927 0.775 . . . . 0.0 113.313 179.428 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.1 m -95.5 144.23 26.16 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.934 1.294 . . . . 0.0 110.191 -179.115 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 -142.82 162.95 34.11 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.605 1.562 . . . . 0.0 112.488 -175.143 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.1 pp -153.48 148.39 26.57 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.845 1.258 . . . . 0.0 111.984 169.154 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 71.0 m -90.24 153.1 20.74 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.701 1.2 . . . . 0.0 109.652 169.383 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -152.95 134.1 4.31 Favored Glycine 0 N--CA 1.471 1.026 0 O-C-N 121.225 -0.922 . . . . 0.0 113.373 176.45 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -119.75 157.57 28.32 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.347 1.059 . . . . 0.0 112.417 -178.856 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.0 tt -151.41 132.17 4.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 124.868 1.267 . . . . 0.0 110.77 177.939 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 44.9 t -65.21 157.82 27.81 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.894 0.877 . . . . 0.0 112.819 178.251 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 3.8 pp -71.51 -9.48 58.27 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 175.024 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -66.5 146.09 99.02 Favored Pre-proline 0 CA--C 1.552 1.023 0 C-N-CA 124.318 1.047 . . . . 0.0 112.057 175.948 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -68.75 -24.6 34.49 Favored 'Trans proline' 0 CA--C 1.539 0.736 0 C-N-CA 123.092 2.528 . . . . 0.0 113.023 -178.746 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.6 ptmt -83.16 1.37 40.87 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 177.827 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.04 163.75 21.66 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.525 1.13 . . . . 0.0 113.751 -174.837 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 22.3 pt20 -149.68 163.07 38.94 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.53 1.932 . . . . 0.0 109.31 175.32 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 67.1 mt -73.13 119.27 19.74 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 CA-C-O 121.799 0.809 . . . . 0.0 111.174 -173.65 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 25.2 ttmt -88.08 124.73 34.07 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 126.857 2.063 . . . . 0.0 109.536 169.688 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -147.72 158.72 44.15 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.266 1.426 . . . . 0.0 111.292 -179.036 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 17.9 m -117.46 -173.54 2.44 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.674 1.59 . . . . 0.0 111.913 179.855 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 98.5 mt -60.02 143.25 52.33 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.125 0.97 . . . . 0.0 111.836 176.533 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 91.8 mtm-85 -66.52 153.35 43.17 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.91 1.284 . . . . 0.0 113.388 -172.619 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.89 162.56 17.15 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.567 1.947 . . . . 0.0 110.811 175.675 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -130.16 142.74 50.56 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.604 1.162 . . . . 0.0 111.618 -177.2 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 50.9 tp -116.09 133.89 55.54 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 125.978 1.711 . . . . 0.0 110.082 173.41 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 43.5 ttm180 -122.36 117.17 25.41 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.881 1.673 . . . . 0.0 109.31 170.427 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 54.4 t -99.99 119.21 47.74 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 N-CA-C 107.861 -1.162 . . . . 0.0 107.861 169.962 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 72.6 p -98.68 139.9 33.7 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.31 1.444 . . . . 0.0 109.422 177.614 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 4.5 pm0 -62.98 146.04 54.02 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.672 0.789 . . . . 0.0 113.119 -173.041 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 42.9 ttt85 -77.68 117.11 18.77 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 124.132 0.973 . . . . 0.0 110.338 -170.179 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 65.6 ttp85 -72.21 140.33 48.66 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.492 0.717 . . . . 0.0 111.671 -174.619 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -75.22 154.27 37.66 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.644 1.177 . . . . 0.0 112.715 176.253 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 . . . . . 0 C--O 1.254 1.334 0 N-CA-C 114.533 1.309 . . . . 0.0 114.533 177.21 . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 27.1 ttt . . . . . 0 N--CA 1.488 1.461 0 CA-C-O 118.358 -0.829 . . . . 0.0 110.391 . . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_exo -60.3 165.59 10.68 Favored 'Trans proline' 0 CA--C 1.544 1.002 0 C-N-CA 124.025 3.15 . . . . 0.0 113.255 172.41 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -54.29 148.64 40.5 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 123.97 3.113 . . . . 0.0 113.892 174.151 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.8 t -162.5 160.53 26.25 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.052 0.941 . . . . 0.0 112.704 -172.502 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -146.82 118.0 7.81 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.642 1.977 . . . . 0.0 110.007 179.332 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 90.2 p -140.91 163.23 43.92 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 125.027 1.331 . . . . 0.0 113.5 -171.114 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -70.87 165.5 79.6 Favored 'Cis proline' 0 C--N 1.353 0.803 0 CA-C-N 119.932 1.011 . . . . 0.0 111.818 -7.945 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.64 -29.52 70.74 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 172.785 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 51.8 tp -141.31 124.63 16.55 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.65 1.58 . . . . 0.0 109.205 172.356 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 61.3 tp -109.53 126.02 53.12 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.489 1.516 . . . . 0.0 109.012 170.685 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.2 t -110.25 125.14 67.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 123.921 0.888 . . . . 0.0 108.784 173.359 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 33.5 m -130.39 162.8 37.62 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.075 0 C-N-CA 124.667 1.187 . . . . 0.0 112.091 174.053 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 16.5 m -88.36 147.48 24.73 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.533 1.133 . . . . 0.0 110.478 171.874 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -58.61 121.56 11.3 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.884 0.874 . . . . 0.0 112.117 -179.514 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 98.98 -2.94 58.34 Favored Glycine 0 CA--C 1.533 1.162 0 C-N-CA 125.844 1.688 . . . . 0.0 114.54 -173.903 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -87.65 158.16 18.92 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 119.743 1.772 . . . . 0.0 112.443 177.314 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -77.48 116.04 17.74 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.429 1.092 . . . . 0.0 110.492 170.633 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -102.63 119.62 39.14 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.993 0.917 . . . . 0.0 110.439 178.528 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 54.1 m -128.84 125.37 37.56 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 119.052 0.842 . . . . 0.0 111.711 -175.996 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -98.09 155.69 17.01 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.068 1.747 . . . . 0.0 110.253 169.826 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 56.5 m -107.97 125.7 51.83 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.094 1.358 . . . . 0.0 109.476 177.344 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 16.6 t -118.37 151.64 37.36 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.825 1.25 . . . . 0.0 111.265 170.458 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 24.8 t -147.94 133.28 18.53 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.161 -0.962 . . . . 0.0 111.76 174.186 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 33.2 m-85 -138.42 156.11 47.87 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 127.699 2.399 . . . . 0.0 110.083 170.369 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.3 t -141.25 138.17 33.06 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.429 1.092 . . . . 0.0 110.13 170.58 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 57.4 m-80 -141.13 167.6 21.8 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.571 1.548 . . . . 0.0 110.681 -178.337 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 10.9 t -151.7 167.46 28.11 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.325 1.45 . . . . 0.0 111.318 -179.034 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 55.5 m 69.36 -30.95 0.2 Allowed 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 128.77 2.828 . . . . 0.0 114.173 -174.295 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -143.68 145.5 32.5 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 127.571 2.348 . . . . 0.0 108.319 175.297 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 70.5 m -77.7 169.11 18.86 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.192 0.997 . . . . 0.0 112.488 176.656 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 24.3 p90 -142.71 156.84 45.08 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 113.959 1.096 . . . . 0.0 113.959 -172.743 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 57.3 t -106.37 135.5 44.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 C-N-CA 126.432 1.893 . . . . 0.0 107.662 169.595 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 20.9 tp -104.57 135.96 45.01 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.639 0.775 . . . . 0.0 110.59 171.656 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -127.92 156.06 43.21 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.293 1.437 . . . . 0.0 111.577 -170.035 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 16.2 t90 -129.39 136.03 49.45 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.778 1.231 . . . . 0.0 111.69 -179.607 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -135.84 145.89 46.9 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.399 1.08 . . . . 0.0 112.815 -176.726 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.8 ttt-85 -103.39 141.78 35.36 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.328 1.451 . . . . 0.0 108.85 168.883 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 31.5 mtp -90.29 145.36 25.04 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 118.747 0.703 . . . . 0.0 112.113 178.15 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 70.8 m -95.81 154.86 38.96 Favored Pre-proline 0 CA--C 1.546 0.82 0 C-N-CA 125.175 1.39 . . . . 0.0 111.182 173.526 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -65.44 -23.4 58.2 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 123.175 2.584 . . . . 0.0 113.088 179.435 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 14.6 m -76.96 9.38 2.97 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.087 1.355 . . . . 0.0 113.534 172.398 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . 0.323 0.0 OUTLIER 70.95 20.84 5.19 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 128.891 2.876 . . . . 0.0 114.555 179.545 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -93.66 -174.31 3.43 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.766 1.226 . . . . 0.0 110.949 170.605 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.5 p -144.15 152.56 41.07 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 126.382 1.873 . . . . 0.0 110.317 -175.546 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -128.68 133.15 48.12 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.436 1.094 . . . . 0.0 111.083 172.937 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -78.07 128.3 33.63 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.834 0.854 . . . . 0.0 111.173 -179.95 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 61.4 mt -100.25 -51.02 3.77 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.819 1.248 . . . . 0.0 111.414 -170.342 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -171.09 173.33 5.07 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.582 1.953 . . . . 0.0 110.483 -176.663 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -158.63 161.64 37.2 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.3 1.44 . . . . 0.0 112.077 -176.977 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -141.23 125.5 10.38 Favored Pre-proline 0 CA--C 1.548 0.889 0 C-N-CA 125.148 1.379 . . . . 0.0 110.192 172.549 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -53.9 152.98 16.94 Favored 'Cis proline' 0 C--N 1.351 0.661 0 CA-C-N 120.257 1.128 . . . . 0.0 113.144 -9.025 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -62.78 140.67 58.77 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 -169.805 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 39.4 t0 -85.09 74.41 10.5 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.192 1.397 . . . . 0.0 110.071 173.95 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 20.8 mmm180 -76.15 -8.05 56.16 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -172.677 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 34.4 m -62.51 -32.53 73.47 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 -170.75 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -135.81 153.33 77.15 Favored Pre-proline 0 CA--C 1.546 0.79 0 C-N-CA 127.097 2.159 . . . . 0.0 110.298 172.088 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_exo -58.46 142.99 98.38 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.482 2.788 . . . . 0.0 112.279 171.358 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -80.98 -31.55 34.89 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-O 119.29 -0.728 . . . . 0.0 113.364 179.978 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 73.18 -52.58 0.71 Allowed 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 128.857 2.863 . . . . 0.0 113.144 174.023 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -80.76 61.65 4.5 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 126.301 1.84 . . . . 0.0 110.582 173.526 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 28.7 m -62.05 -6.59 3.05 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.767 1.627 . . . . 0.0 115.157 -172.706 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 8.8 ptp180 -61.55 -26.18 67.78 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 113.666 0.988 . . . . 0.0 113.666 170.587 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -93.35 135.62 34.39 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.165 0.986 . . . . 0.0 111.634 -179.349 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 52.6 mtm180 -139.96 153.12 46.82 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.776 1.23 . . . . 0.0 112.255 177.937 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 63.6 t -126.5 125.55 67.48 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 125.265 1.426 . . . . 0.0 108.094 168.139 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 87.2 m -130.43 126.62 37.46 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.249 1.02 . . . . 0.0 110.235 -178.414 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -80.89 139.87 35.66 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.654 0.781 . . . . 0.0 110.748 174.369 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 16.3 mt -80.85 158.46 70.44 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 124.078 0.951 . . . . 0.0 111.585 177.117 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -65.08 -4.21 8.6 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 123.429 2.752 . . . . 0.0 114.99 179.142 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -70.59 -25.97 63.3 Favored 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 120.562 1.528 . . . . 0.0 112.467 169.908 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 96.58 -3.94 63.6 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 126.214 1.864 . . . . 0.0 114.628 173.701 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 31.2 ptt180 -154.62 73.71 0.91 Allowed 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.937 1.695 . . . . 0.0 110.501 176.17 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -178.02 143.02 0.3 Allowed 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 128.951 2.9 . . . . 0.0 107.905 179.389 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -146.46 136.83 23.82 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.489 0.661 . . . . 0.0 112.757 -168.693 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -98.73 125.55 44.08 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.257 1.423 . . . . 0.0 111.615 170.066 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -104.23 103.24 12.98 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 127.172 2.189 . . . . 0.0 108.39 175.184 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 54.5 p -117.12 132.63 56.62 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 114.842 1.423 . . . . 0.0 114.842 -169.491 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 12.3 t -96.36 111.31 26.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 126.109 1.763 . . . . 0.0 106.961 167.312 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 94.3 t -78.38 127.94 38.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 124.785 1.234 . . . . 0.0 109.302 175.061 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 13.8 tpt180 57.79 54.53 6.14 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.874 1.27 . . . . 0.0 111.092 174.882 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.47 136.85 58.1 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.226 -0.921 . . . . 0.0 113.171 -168.723 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 45.4 mmm-85 -111.38 160.53 16.98 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 125.553 1.541 . . . . 0.0 111.021 -179.248 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 77.3 mtm180 -55.84 -22.59 25.8 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 113.515 0.932 . . . . 0.0 113.515 172.323 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -56.72 -35.51 68.64 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.754 1.621 . . . . 0.0 113.654 168.322 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -83.89 -23.3 31.31 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.862 0.865 . . . . 0.0 112.99 -168.595 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 48.8 m -49.69 139.29 13.03 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.789 1.236 . . . . 0.0 113.119 177.417 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 148.13 -165.87 28.96 Favored Glycine 0 N--CA 1.472 1.033 0 C-N-CA 124.326 0.965 . . . . 0.0 113.359 -176.287 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.2 m -92.35 142.69 27.17 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.982 1.313 . . . . 0.0 110.533 -178.093 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 45.1 m-85 -135.5 161.16 36.27 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.848 1.659 . . . . 0.0 111.91 -179.299 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -148.95 153.28 37.74 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.747 1.219 . . . . 0.0 112.245 172.927 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 49.6 t -101.32 155.4 18.06 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.648 1.579 . . . . 0.0 110.221 169.85 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -163.29 133.6 3.11 Favored Glycine 0 N--CA 1.471 0.999 0 N-CA-C 115.345 0.898 . . . . 0.0 115.345 174.587 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -94.97 157.3 15.96 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.47 1.108 . . . . 0.0 112.76 179.793 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 18.9 tt -152.59 135.41 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 125.065 1.346 . . . . 0.0 110.184 174.673 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 69.7 p -75.53 161.57 29.06 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.68 0.792 . . . . 0.0 113.002 178.2 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.51 -3.39 8.49 Favored 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 115.51 1.67 . . . . 0.0 115.51 178.709 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -73.84 144.18 82.4 Favored Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 124.468 1.107 . . . . 0.0 112.652 -176.306 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -56.53 -32.86 91.14 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 123.362 2.708 . . . . 0.0 113.754 172.502 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.09 4.34 34.61 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 115.046 1.499 . . . . 0.0 115.046 -179.604 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.31 160.32 24.78 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.324 1.05 . . . . 0.0 113.789 -173.833 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -145.34 162.82 36.32 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.821 1.649 . . . . 0.0 110.124 175.017 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 57.8 mt -80.68 119.2 29.78 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 123.62 0.768 . . . . 0.0 111.429 -169.973 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -82.37 93.33 7.16 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.398 1.479 . . . . 0.0 108.303 168.605 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 60.2 mt-10 -79.37 144.49 34.12 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.652 0.781 . . . . 0.0 112.743 -174.658 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 50.2 m -87.37 169.28 12.4 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.814 1.245 . . . . 0.0 113.277 169.776 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 94.2 mt -65.65 150.62 48.16 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.574 0.75 . . . . 0.0 109.888 168.003 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? -76.77 148.23 36.79 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.42 0.688 . . . . 0.0 112.373 -172.531 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -117.95 166.35 12.61 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.429 1.891 . . . . 0.0 110.596 170.093 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -126.36 139.02 53.61 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.656 1.182 . . . . 0.0 111.061 176.84 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 63.7 tp -106.8 131.37 53.99 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.45 1.5 . . . . 0.0 109.531 169.82 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -121.7 109.54 14.85 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.322 1.449 . . . . 0.0 109.199 170.302 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 24.1 t -95.95 114.36 32.48 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 169.979 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 68.9 p -95.73 146.14 24.75 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.452 1.501 . . . . 0.0 109.612 -179.787 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -63.15 148.34 48.26 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 121.627 0.727 . . . . 0.0 112.539 -175.968 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 34.2 ttm180 -75.37 119.74 19.87 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 124.156 0.982 . . . . 0.0 110.02 -175.551 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 31.1 ttp180 -72.17 149.17 44.92 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.416 0.687 . . . . 0.0 111.898 -175.429 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -66.37 154.31 40.43 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.692 0.797 . . . . 0.0 110.416 167.301 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 . . . . . 0 C--O 1.252 1.229 0 CA-C-O 117.669 -1.157 . . . . 0.0 113.454 -177.1 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 48.4 m . . . . . 0 N--CA 1.469 0.509 0 CA-C-O 121.05 0.452 . . . . 0.0 110.063 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -147.0 119.71 8.59 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.894 1.677 . . . . 0.0 109.385 178.026 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 88.3 p -140.85 159.13 63.47 Favored Pre-proline 0 CA--C 1.548 0.904 0 N-CA-C 113.831 1.048 . . . . 0.0 113.831 -168.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -70.06 160.75 88.38 Favored 'Cis proline' 0 C--N 1.355 0.893 0 CA-C-N 119.33 0.796 . . . . 0.0 111.513 -5.633 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.38 -20.52 66.42 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 176.325 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 36.5 tp -141.45 116.89 10.18 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 125.43 1.492 . . . . 0.0 108.819 169.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 61.2 tp -104.71 121.81 44.37 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.282 1.433 . . . . 0.0 108.856 170.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 24.0 t -110.67 122.08 64.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 124.251 1.02 . . . . 0.0 108.311 174.812 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 27.8 m -133.01 167.67 26.1 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 C-N-CA 124.849 1.26 . . . . 0.0 111.777 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.3 m -93.7 150.97 19.97 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.0 1.32 . . . . 0.0 110.66 174.485 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -46.5 125.67 7.24 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.71 1.204 . . . . 0.0 111.703 168.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.96 -1.11 82.93 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 125.906 1.717 . . . . 0.0 114.813 -179.043 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -74.67 151.82 39.22 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 119.801 1.801 . . . . 0.0 112.65 173.652 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 68.0 m-20 -86.64 88.19 7.61 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.2 1.0 . . . . 0.0 109.188 171.428 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -77.08 114.42 15.86 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.723 0.809 . . . . 0.0 112.351 -167.81 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 53.0 m -116.27 130.58 56.85 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -171.744 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -108.57 159.6 16.58 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 127.056 2.142 . . . . 0.0 110.027 168.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 87.9 m -112.97 126.34 55.38 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.375 1.07 . . . . 0.0 110.542 175.7 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 29.9 m -98.31 148.88 23.2 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.152 0.981 . . . . 0.0 110.215 167.883 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 39.3 t -139.06 127.4 22.81 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.327 1.051 . . . . 0.0 109.443 172.205 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 . . . . . 0 N--CA 1.467 0.397 0 C-N-CA 124.861 1.264 . . . . 0.0 112.411 -173.089 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 52.4 p90 . . . . . 0 CA--C 1.541 0.63 0 CA-C-O 120.851 0.358 . . . . 0.0 111.836 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 45.6 t -95.9 132.89 38.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 125.326 1.45 . . . . 0.0 107.765 169.098 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 10.7 tp -99.41 142.43 30.9 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.418 1.487 . . . . 0.0 108.008 168.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -145.56 158.97 43.77 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.409 1.084 . . . . 0.0 113.191 -176.2 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 16.1 t90 -134.43 141.04 46.68 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.438 1.095 . . . . 0.0 112.512 -170.663 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -136.92 147.99 46.73 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -172.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 55.5 ttt85 -99.78 129.99 45.94 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 166.852 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 24.7 tpp -98.49 127.31 44.37 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.258 1.823 . . . . 0.0 109.382 179.299 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 44.9 m -90.84 160.59 37.91 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 125.469 1.508 . . . . 0.0 113.052 -174.279 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -67.44 -18.7 49.53 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 123.263 2.642 . . . . 0.0 112.827 173.024 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 42.5 p -76.92 -3.78 40.5 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.657 1.583 . . . . 0.0 113.367 169.54 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 32.0 m-80 73.77 20.8 2.88 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 128.287 2.635 . . . . 0.0 113.464 179.291 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.3 pp0? -97.75 169.59 9.57 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.818 0.847 . . . . 0.0 111.497 169.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.6 p -130.16 137.34 50.06 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.181 1.393 . . . . 0.0 110.395 -176.021 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -118.65 131.53 56.17 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.825 1.25 . . . . 0.0 111.219 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 76.9 tttt -75.93 132.44 40.26 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.73 1.212 . . . . 0.0 111.323 -175.551 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 76.1 mt -111.48 -47.14 3.2 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.689 1.196 . . . . 0.0 112.435 -170.449 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -167.74 169.72 11.48 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.607 1.563 . . . . 0.0 110.938 -175.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -158.72 159.39 35.19 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.078 1.351 . . . . 0.0 112.501 -177.572 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -145.78 118.26 5.15 Favored Pre-proline 0 CA--C 1.548 0.9 0 C-N-CA 125.676 1.591 . . . . 0.0 110.866 175.402 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo . . . . . 0 C--N 1.351 0.676 0 CA-C-N 119.997 1.035 . . . . 0.0 112.592 -12.427 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 41.0 mtm180 . . . . . 0 N--CA 1.471 0.602 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -67.61 111.28 4.09 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.397 1.079 . . . . 0.0 110.038 171.332 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 44.3 ttp85 -120.5 139.8 52.36 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.351 1.86 . . . . 0.0 111.436 -173.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 8.6 t -109.82 131.23 61.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 125.021 1.328 . . . . 0.0 108.845 168.851 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 73.7 m -130.12 135.73 48.53 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.326 1.05 . . . . 0.0 109.731 172.774 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -92.7 126.97 38.02 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.047 1.339 . . . . 0.0 109.464 -176.025 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 86.6 mt -90.66 151.48 43.94 Favored Pre-proline 0 N--CA 1.472 0.662 0 C-N-CA 123.837 0.855 . . . . 0.0 112.968 -174.319 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -64.62 -2.41 5.18 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 123.783 2.989 . . . . 0.0 114.058 176.386 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -64.92 -25.97 68.11 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 119.572 1.078 . . . . 0.0 112.648 169.496 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 95.57 -34.09 5.08 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 126.209 1.861 . . . . 0.0 114.016 176.546 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 46.2 mtm105 -138.32 73.64 1.45 Allowed 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.117 1.367 . . . . 0.0 109.615 169.359 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -165.11 140.38 5.26 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 127.77 2.428 . . . . 0.0 107.132 177.773 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -143.7 134.85 25.68 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 -167.001 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.4 t-160 -96.16 113.41 25.01 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 127.452 2.301 . . . . 0.0 110.341 -177.094 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 24.9 mmt -107.7 105.64 15.59 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.875 1.67 . . . . 0.0 109.782 179.597 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 8.2 t -116.48 125.27 51.72 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -169.593 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 21.4 t -87.93 88.8 2.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 N-CA-C 106.036 -1.838 . . . . 0.0 106.036 167.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 87.7 t -65.79 119.37 10.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 178.664 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 62.6 72.29 0.5 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.804 1.641 . . . . 0.0 111.308 -177.287 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -80.39 139.2 36.63 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.31 1.044 . . . . 0.0 112.088 178.381 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -112.07 170.05 8.42 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.976 1.71 . . . . 0.0 109.847 175.122 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 27.7 mtp180 -56.23 -34.98 66.84 Favored 'General case' 0 N--CA 1.48 1.066 0 O-C-N 120.86 -1.15 . . . . 0.0 113.436 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 23.7 p30 -63.96 -18.72 64.55 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 115.161 1.541 . . . . 0.0 115.161 175.122 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -80.56 -7.35 59.21 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.071 0.948 . . . . 0.0 112.656 174.032 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.4 m -61.85 134.89 57.27 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.086 -1.634 . . . . 0.0 111.11 171.485 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 159.96 -169.2 35.85 Favored Glycine 0 N--CA 1.471 0.979 0 C-N-CA 124.334 0.969 . . . . 0.0 113.315 -177.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 7.7 m -91.84 142.71 27.28 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.349 1.06 . . . . 0.0 110.319 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -138.98 155.82 47.71 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.539 1.536 . . . . 0.0 111.967 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -159.55 154.56 24.9 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.188 1.395 . . . . 0.0 112.877 178.141 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 3.3 t -107.91 167.01 10.28 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.091 1.756 . . . . 0.0 111.342 -173.424 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -159.76 168.79 35.63 Favored Glycine 0 CA--C 1.527 0.818 0 O-C-N 121.196 -0.94 . . . . 0.0 114.208 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -143.9 155.59 44.14 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.954 1.302 . . . . 0.0 112.152 174.715 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.8 tt -155.68 138.05 6.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 125.652 1.581 . . . . 0.0 110.888 178.824 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 4.8 m -64.51 161.52 17.14 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.458 1.103 . . . . 0.0 113.067 179.041 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 43.6 mt -74.24 -16.79 60.94 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 -178.698 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -69.37 150.11 97.16 Favored Pre-proline 0 CA--C 1.552 1.027 0 C-N-CA 124.619 1.167 . . . . 0.0 112.642 178.634 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.59 -20.93 35.01 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 123.106 2.537 . . . . 0.0 113.1 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -82.93 0.84 42.53 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 124.784 1.234 . . . . 0.0 113.964 178.071 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.68 168.52 13.0 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.167 1.387 . . . . 0.0 113.83 -176.543 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -147.28 156.29 42.8 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.859 1.663 . . . . 0.0 110.038 175.911 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 52.8 mt -81.57 127.03 39.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 123.082 0.553 . . . . 0.0 111.303 -171.342 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -95.09 114.49 26.3 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.251 1.82 . . . . 0.0 108.17 168.036 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -94.52 150.43 20.26 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.46 1.104 . . . . 0.0 111.866 -176.508 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 60.2 p -85.59 176.64 8.08 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.777 0.831 . . . . 0.0 112.498 169.05 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -69.7 159.88 32.68 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 121.676 -0.64 . . . . 0.0 109.988 165.911 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -93.44 159.85 15.07 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 -176.2 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -140.65 163.87 31.72 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.412 1.885 . . . . 0.0 111.827 178.161 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -105.28 138.88 40.78 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.105 1.362 . . . . 0.0 112.199 177.468 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 42.7 tp -108.52 131.37 54.9 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 126.343 1.857 . . . . 0.0 107.652 167.393 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 30.4 ttm180 -133.78 113.23 12.07 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 124.456 1.102 . . . . 0.0 109.532 -177.833 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 30.8 t -107.08 112.81 41.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 C-N-CA 124.394 1.078 . . . . 0.0 109.301 -175.724 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 72.7 p -93.44 160.43 14.81 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 126.622 1.969 . . . . 0.0 111.177 -176.062 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -62.5 142.91 57.71 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.857 0.863 . . . . 0.0 113.226 -172.217 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? . . . . . 0 N--CA 1.467 0.424 0 C-N-CA 124.473 1.109 . . . . 0.0 108.747 176.271 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 58.7 m . . . . . 0 N--CA 1.468 0.471 0 CA-C-O 121.222 0.534 . . . . 0.0 110.504 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 93.9 t80 -140.37 116.95 10.83 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 126.972 2.109 . . . . 0.0 108.214 174.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 38.1 m -140.83 160.95 56.64 Favored Pre-proline 0 N--CA 1.479 0.983 0 C-N-CA 124.545 1.138 . . . . 0.0 113.494 -168.044 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -68.53 156.88 88.86 Favored 'Cis proline' 0 C--N 1.355 0.897 0 CA-C-N 119.982 1.029 . . . . 0.0 111.751 -2.117 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.33 -28.07 64.72 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.802 0.841 . . . . 0.0 113.074 175.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -134.96 118.13 16.53 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 126.224 1.81 . . . . 0.0 109.187 173.157 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 51.7 tp -109.1 122.3 47.0 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.963 0.905 . . . . 0.0 109.761 171.309 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 32.2 t -106.84 122.92 61.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 124.132 0.973 . . . . 0.0 109.269 175.571 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.0 m -128.98 172.34 15.5 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 C-N-CA 125.04 1.336 . . . . 0.0 112.036 170.875 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 31.9 m -99.14 151.82 20.56 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.812 1.645 . . . . 0.0 110.693 177.195 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -47.19 122.07 4.25 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.998 1.319 . . . . 0.0 112.013 169.413 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 85.79 -1.85 87.95 Favored Glycine 0 CA--C 1.532 1.123 0 C-N-CA 125.736 1.636 . . . . 0.0 114.576 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 39.4 t0 -87.09 157.41 19.41 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.245 1.523 . . . . 0.0 111.393 175.133 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -84.08 150.62 25.45 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 121.903 0.859 . . . . 0.0 111.302 169.736 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -132.41 131.25 41.6 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.267 1.827 . . . . 0.0 110.03 -175.492 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 89.8 m -131.58 127.05 36.33 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.286 0.948 . . . . 0.0 111.82 179.167 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -100.11 159.54 15.02 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.002 1.721 . . . . 0.0 110.516 169.525 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 58.8 m -110.32 132.5 54.12 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.661 1.584 . . . . 0.0 109.88 174.455 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 39.5 t -116.73 144.1 44.86 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.991 1.716 . . . . 0.0 112.003 173.067 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 80.9 p -151.41 140.51 21.18 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.713 0.805 . . . . 0.0 112.115 171.849 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 . . . . . 0 CA--C 1.539 0.52 0 C-N-CA 126.49 1.916 . . . . 0.0 112.754 -174.726 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 54.2 p90 . . . . . 0 CA--C 1.538 0.481 0 CA-C-O 121.159 0.504 . . . . 0.0 111.999 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.3 t -96.01 135.76 29.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 125.594 1.557 . . . . 0.0 107.646 169.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -119.41 129.23 54.68 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.169 1.388 . . . . 0.0 108.841 -175.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -130.94 155.72 46.31 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.282 1.433 . . . . 0.0 113.144 -168.851 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 18.2 t90 -123.32 139.09 54.39 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.662 1.185 . . . . 0.0 112.257 179.561 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -133.07 147.66 52.18 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.214 1.406 . . . . 0.0 113.665 -173.693 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 51.2 ttp180 -110.28 141.11 43.73 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 127.419 2.288 . . . . 0.0 108.567 169.281 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 38.2 mtp -92.94 145.87 24.05 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.252 0.933 . . . . 0.0 112.155 178.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 24.0 p -90.85 165.54 21.87 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 123.626 0.77 . . . . 0.0 112.983 176.606 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.01 -29.04 89.59 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 123.589 2.859 . . . . 0.0 113.358 169.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 36.1 m -83.39 12.46 5.45 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.195 1.398 . . . . 0.0 112.89 174.645 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 63.4 t30 63.44 23.56 13.74 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.554 1.941 . . . . 0.0 113.353 178.105 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 46.4 mm-40 -89.7 -172.73 3.67 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.483 0.713 . . . . 0.0 109.798 170.723 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.4 p -137.58 143.5 41.55 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.347 1.459 . . . . 0.0 110.902 -176.537 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -123.73 129.77 51.61 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 126.572 1.949 . . . . 0.0 109.775 -178.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 74.3 tttt -86.6 119.66 27.08 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.604 1.162 . . . . 0.0 110.962 -171.525 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 65.9 mt -95.04 -51.07 4.81 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.696 1.199 . . . . 0.0 112.381 -168.89 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -167.37 171.72 10.34 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.321 1.448 . . . . 0.0 111.564 -174.139 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -150.09 158.36 44.08 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.104 1.362 . . . . 0.0 113.112 -169.793 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -137.26 136.94 21.33 Favored Pre-proline 0 CA--C 1.548 0.895 0 C-N-CA 125.687 1.595 . . . . 0.0 110.203 169.375 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo . . . . . 0 C--N 1.352 0.75 0 CA-C-N 120.279 1.136 . . . . 0.0 112.089 -8.566 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.3 ptp85 . . . . . 0 N--CA 1.478 0.957 0 N-CA-C 115.247 1.573 . . . . 0.0 115.247 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -111.88 140.48 46.5 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.714 1.606 . . . . 0.0 111.138 177.359 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 21.2 ttt-85 -144.4 143.72 31.06 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.832 0.853 . . . . 0.0 113.024 174.523 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 60.1 t -111.75 127.15 69.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 125.154 1.381 . . . . 0.0 107.704 167.58 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 76.3 m -130.55 129.55 42.96 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.09 0.956 . . . . 0.0 109.954 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -80.27 139.74 36.52 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.49 0.716 . . . . 0.0 110.978 176.04 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 30.6 mt -84.56 160.38 56.52 Favored Pre-proline 0 CA--C 1.545 0.766 0 C-N-CA 124.906 1.282 . . . . 0.0 111.669 176.097 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -62.32 -5.07 6.11 Favored 'Trans proline' 0 CA--C 1.543 0.931 0 C-N-CA 123.542 2.828 . . . . 0.0 114.704 174.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -62.64 -26.13 68.47 Favored 'General case' 0 CA--C 1.551 1.019 0 CA-C-N 119.569 1.077 . . . . 0.0 112.746 169.085 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 94.08 -17.06 59.56 Favored Glycine 0 N--CA 1.475 1.274 0 C-N-CA 125.59 1.567 . . . . 0.0 114.692 173.777 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 11.0 ptp180 -154.5 73.61 0.91 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.477 1.511 . . . . 0.0 109.839 169.566 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -166.44 140.6 4.19 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 128.652 2.781 . . . . 0.0 107.003 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -141.16 143.04 34.02 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 -166.73 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 17.1 m170 -105.55 132.84 51.21 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.524 1.529 . . . . 0.0 111.711 169.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -112.73 101.82 9.9 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 127.154 2.182 . . . . 0.0 109.298 -178.023 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 60.6 m -109.23 124.12 50.35 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 -169.087 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 37.2 t -93.53 125.99 46.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 126.278 1.831 . . . . 0.0 106.401 167.094 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 57.9 t -96.57 126.57 49.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 124.069 0.948 . . . . 0.0 109.408 171.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 67.1 ttt180 58.32 66.15 1.15 Allowed 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.778 1.631 . . . . 0.0 111.826 174.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -72.37 135.54 45.89 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 121.351 -0.843 . . . . 0.0 111.798 -178.514 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -111.49 164.86 12.52 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.93 1.692 . . . . 0.0 110.202 174.33 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 31.0 mtp180 -56.88 -32.99 66.41 Favored 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -171.664 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -64.97 -16.11 62.99 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 175.598 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 65.5 m-20 -79.73 -13.52 59.39 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 119.329 0.968 . . . . 0.0 112.8 173.814 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 20.4 m -63.45 129.23 39.36 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 120.868 -1.145 . . . . 0.0 111.566 177.8 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 158.8 -169.04 35.07 Favored Glycine 0 N--CA 1.47 0.908 0 C-N-CA 124.183 0.896 . . . . 0.0 113.286 -172.342 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.4 m -92.79 143.27 26.45 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.727 1.211 . . . . 0.0 111.267 -173.156 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -141.73 157.19 45.35 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.542 1.937 . . . . 0.0 111.267 -177.494 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -160.53 159.93 31.29 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.855 1.262 . . . . 0.0 113.617 177.668 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 39.1 t -103.07 149.47 24.56 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.911 1.685 . . . . 0.0 111.57 177.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -144.57 152.64 24.55 Favored Glycine 0 N--CA 1.471 1.015 0 C-N-CA 124.688 1.137 . . . . 0.0 113.182 175.852 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -132.39 154.63 49.62 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.629 1.171 . . . . 0.0 112.775 -176.741 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.3 tt -153.31 135.41 6.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 125.104 1.361 . . . . 0.0 110.995 177.211 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 12.6 m -67.98 158.28 33.17 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 121.099 -1.001 . . . . 0.0 112.498 177.632 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.7 -9.18 56.6 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 115.689 1.737 . . . . 0.0 115.689 -177.247 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -78.38 144.16 65.67 Favored Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 124.241 1.016 . . . . 0.0 112.281 -178.374 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -55.56 -29.04 68.01 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 123.748 2.965 . . . . 0.0 114.858 177.22 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -76.99 -5.99 50.85 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 115.056 1.502 . . . . 0.0 115.056 179.394 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.41 164.2 23.54 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.519 1.127 . . . . 0.0 113.365 -176.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -144.59 161.34 39.37 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.674 1.589 . . . . 0.0 110.295 173.75 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 56.8 mt -78.98 118.17 25.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 123.65 0.78 . . . . 0.0 111.158 -172.002 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 59.0 tttp -89.62 137.53 32.25 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.719 1.608 . . . . 0.0 109.214 168.888 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -115.29 152.75 32.18 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.448 1.099 . . . . 0.0 112.147 -173.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 78.3 p -97.59 172.55 7.65 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.077 1.351 . . . . 0.0 114.118 177.34 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 14.4 tp -69.99 119.8 14.75 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.144 1.378 . . . . 0.0 108.607 169.374 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 34.8 ptt-85 -71.35 163.93 26.72 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.101 1.36 . . . . 0.0 113.879 -175.041 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -142.64 169.65 17.18 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.807 2.043 . . . . 0.0 111.234 179.492 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -117.65 146.16 43.87 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 114.055 1.131 . . . . 0.0 114.055 174.236 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 66.8 tp -100.21 137.11 39.1 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 127.112 2.165 . . . . 0.0 108.875 169.227 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 29.3 ttm180 -132.02 117.56 18.55 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.293 1.437 . . . . 0.0 109.964 178.764 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 40.6 t -106.46 113.21 42.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 125.226 1.41 . . . . 0.0 108.904 178.741 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 73.8 p -95.01 160.69 14.46 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.824 1.65 . . . . 0.0 111.47 -178.349 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -57.74 144.9 36.46 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.732 1.213 . . . . 0.0 113.686 -173.809 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 69.7 ttp85 . . . . . 0 C--O 1.236 0.368 0 C-N-CA 124.278 1.031 . . . . 0.0 109.607 179.38 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.1 t . . . . . 0 N--CA 1.476 0.834 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -152.78 119.88 5.84 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.66 1.984 . . . . 0.0 110.658 175.311 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 94.9 p -140.93 164.19 37.72 Favored Pre-proline 0 CA--C 1.553 1.075 0 C-N-CA 125.446 1.498 . . . . 0.0 112.755 -172.704 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -70.24 170.65 59.52 Favored 'Cis proline' 0 C--N 1.355 0.873 0 CA-C-N 120.629 1.26 . . . . 0.0 112.396 -2.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.04 -32.94 74.42 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 171.558 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 49.1 tp -144.92 124.69 13.36 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.559 1.544 . . . . 0.0 109.586 171.672 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 62.1 tp -102.18 132.75 47.9 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.975 1.31 . . . . 0.0 108.888 169.054 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 24.7 t -112.65 127.29 69.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 124.072 0.949 . . . . 0.0 108.466 171.037 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 33.2 m -131.4 166.26 29.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 124.624 1.17 . . . . 0.0 111.708 175.094 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 25.4 m -90.5 148.91 22.43 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.258 1.023 . . . . 0.0 110.229 173.393 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -59.13 116.05 3.59 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.544 1.538 . . . . 0.0 111.357 176.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.17 5.47 65.7 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 126.385 1.945 . . . . 0.0 114.765 -174.831 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -92.05 154.78 18.54 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.355 1.578 . . . . 0.0 112.132 173.223 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 49.5 m-80 -71.08 120.44 16.65 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.455 1.102 . . . . 0.0 110.753 173.22 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -97.9 128.09 44.27 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 117.867 -1.063 . . . . 0.0 110.076 174.457 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 28.4 m -132.74 132.08 41.89 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.169 0.988 . . . . 0.0 111.184 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -119.97 159.55 24.5 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 128.03 2.532 . . . . 0.0 109.982 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 49.7 m -105.44 124.44 49.55 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.332 1.053 . . . . 0.0 109.468 178.216 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 54.1 t -118.45 150.37 39.69 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.849 1.259 . . . . 0.0 110.908 169.865 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 27.4 t -152.9 146.49 25.04 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 120.734 -1.229 . . . . 0.0 111.763 169.534 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 48.3 m-85 . . . . . 0 CA--C 1.536 0.413 0 C-N-CA 127.981 2.513 . . . . 0.0 110.887 172.801 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 51.6 p90 . . . . . 0 CA--C 1.538 0.49 0 CA-C-O 121.107 0.48 . . . . 0.0 112.171 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 24.8 t -96.05 133.58 36.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 125.48 1.512 . . . . 0.0 107.853 172.485 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 14.6 tp -99.42 140.76 33.13 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.445 1.098 . . . . 0.0 110.088 172.8 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -132.32 151.98 51.61 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.466 1.906 . . . . 0.0 110.507 -179.433 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 14.1 t90 -125.9 146.15 49.96 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.091 0.956 . . . . 0.0 112.405 178.098 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -141.07 143.52 34.4 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 -169.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -103.96 142.05 35.1 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.05 1.34 . . . . 0.0 107.951 167.126 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 22.6 mtp -88.49 145.91 25.48 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 118.897 0.771 . . . . 0.0 112.659 179.441 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 64.5 m -96.1 152.26 38.76 Favored Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 125.134 1.374 . . . . 0.0 110.923 171.158 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -67.52 -12.62 36.32 Favored 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 123.632 2.888 . . . . 0.0 113.621 -179.4 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 29.1 p -76.96 4.04 10.84 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 126.255 1.822 . . . . 0.0 113.633 169.839 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 59.8 t30 67.04 41.51 2.63 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.88 2.072 . . . . 0.0 111.347 -174.387 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 21.5 mm-40 -121.46 -172.69 2.47 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.59 1.956 . . . . 0.0 109.594 176.037 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 12.5 p -146.3 152.56 39.34 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.102 1.361 . . . . 0.0 111.404 -172.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -127.04 132.37 50.72 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.988 1.315 . . . . 0.0 110.919 173.781 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -78.75 124.98 28.76 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.484 1.114 . . . . 0.0 111.21 -175.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 74.0 mt -100.66 -44.61 5.77 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.341 1.456 . . . . 0.0 112.829 -169.684 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -166.21 170.92 12.79 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.165 1.786 . . . . 0.0 110.638 -171.463 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -155.93 163.43 39.76 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.661 1.184 . . . . 0.0 112.796 -177.017 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -141.8 121.31 8.1 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 125.269 1.428 . . . . 0.0 110.035 169.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo . . . . . 0 C--N 1.352 0.736 0 CA-C-N 120.378 1.171 . . . . 0.0 112.984 -7.287 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 43.7 mtm180 . . . . . 0 CA--C 1.532 0.286 0 N-CA-C 113.803 1.038 . . . . 0.0 113.803 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -65.03 129.46 39.79 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.356 1.462 . . . . 0.0 110.813 169.291 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 59.0 ttp85 -144.45 154.0 42.48 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.733 1.613 . . . . 0.0 112.102 -170.904 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 17.7 t -117.54 138.02 49.57 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 125.994 1.718 . . . . 0.0 110.166 173.16 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 3.1 m -114.54 128.38 56.3 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.237 1.415 . . . . 0.0 110.153 171.262 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 28.0 tp60 -84.84 122.38 29.07 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.531 1.132 . . . . 0.0 108.222 168.642 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 24.6 mt -84.56 154.96 62.52 Favored Pre-proline 0 N--CA 1.472 0.668 0 CA-C-O 118.766 -0.635 . . . . 0.0 110.751 176.001 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -65.95 -4.93 10.99 Favored 'Trans proline' 0 CA--C 1.54 0.777 0 C-N-CA 123.571 2.847 . . . . 0.0 113.926 176.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -64.95 -26.12 68.17 Favored 'General case' 0 CA--C 1.55 0.96 0 CA-C-N 119.434 1.016 . . . . 0.0 112.182 169.168 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 85.44 -34.09 3.34 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 126.592 2.044 . . . . 0.0 113.867 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 17.2 mtp180 -125.88 73.51 1.35 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.771 1.228 . . . . 0.0 109.197 174.284 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 174.12 142.2 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 128.757 2.823 . . . . 0.0 109.057 -174.701 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 84.6 m-85 -149.79 151.46 33.6 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.553 1.141 . . . . 0.0 112.66 -167.694 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 5.8 m-70 -116.34 114.48 24.37 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.512 0.725 . . . . 0.0 111.344 169.385 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 24.6 mmt -84.23 144.04 29.19 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.293 1.037 . . . . 0.0 109.371 172.499 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 72.3 p -151.36 151.77 32.21 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 115.565 1.691 . . . . 0.0 115.565 -179.146 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 16.0 t -109.69 116.2 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 125.526 1.531 . . . . 0.0 107.466 169.318 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 96.9 t -70.86 112.52 5.78 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 170.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 80.5 mtt85 57.49 77.09 0.29 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.392 1.477 . . . . 0.0 111.317 178.517 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.29 132.88 45.56 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.595 1.158 . . . . 0.0 111.325 -179.437 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 8.6 mpt_? -105.84 163.26 12.86 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.767 1.627 . . . . 0.0 109.989 176.143 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 73.9 mtm180 -57.52 -20.23 30.12 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 175.691 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -54.59 -29.95 53.06 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.977 1.711 . . . . 0.0 113.668 167.568 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 36.4 m-20 -93.21 -12.74 29.52 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.059 1.344 . . . . 0.0 114.551 -168.284 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 49.5 m -59.42 139.46 57.06 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 119.602 1.092 . . . . 0.0 112.768 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 149.35 -163.83 29.27 Favored Glycine 0 N--CA 1.472 1.053 0 C-N-CA 124.131 0.872 . . . . 0.0 113.435 -178.132 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.7 m -92.64 147.53 22.8 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.006 1.322 . . . . 0.0 110.702 -178.063 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -142.29 158.75 43.37 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.641 1.976 . . . . 0.0 111.253 -176.126 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.5 pp -154.36 158.84 40.69 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.914 1.286 . . . . 0.0 112.112 172.613 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 9.3 t -108.45 161.48 15.0 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.071 1.748 . . . . 0.0 110.291 177.815 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -157.46 155.3 26.29 Favored Glycine 0 N--CA 1.47 0.943 0 O-C-N 120.945 -1.097 . . . . 0.0 114.36 176.26 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -130.58 154.2 48.09 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.433 1.093 . . . . 0.0 112.818 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.6 tt -148.21 135.3 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 125.428 1.491 . . . . 0.0 110.528 176.883 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 23.3 m -67.04 161.1 25.16 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -179.285 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.26 -17.5 64.55 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 -175.657 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -78.51 148.9 74.33 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 124.744 1.218 . . . . 0.0 112.473 -177.36 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -67.9 -23.08 41.5 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.108 2.539 . . . . 0.0 113.069 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.8 pttp -80.31 -1.76 42.36 Favored 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 114.654 1.353 . . . . 0.0 114.654 176.48 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -67.83 164.32 19.89 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.731 1.212 . . . . 0.0 113.135 -179.442 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -137.05 155.77 49.24 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.771 1.628 . . . . 0.0 109.394 176.04 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 50.8 mt -79.24 125.25 38.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 123.343 0.657 . . . . 0.0 110.673 -176.406 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -95.69 120.91 36.79 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.899 1.68 . . . . 0.0 109.414 169.767 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -91.57 151.81 20.57 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.661 1.185 . . . . 0.0 112.223 -177.743 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 56.0 p -85.99 178.96 7.09 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.347 1.059 . . . . 0.0 112.426 169.495 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -71.67 159.33 34.59 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.523 -0.735 . . . . 0.0 110.688 166.745 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 70.3 mtt180 -75.41 143.43 42.73 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 123.991 0.916 . . . . 0.0 112.172 -178.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -124.17 166.46 15.79 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.749 2.02 . . . . 0.0 110.105 169.348 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -126.66 152.76 46.29 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.579 1.151 . . . . 0.0 111.707 177.288 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 64.7 tp -125.35 132.9 52.75 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 126.181 1.792 . . . . 0.0 109.4 172.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 53.9 ttp180 -123.0 117.19 24.91 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.948 1.299 . . . . 0.0 109.875 169.778 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 40.8 t -96.29 120.37 45.57 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 169.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 82.8 p -99.07 149.29 23.17 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.752 1.621 . . . . 0.0 109.932 177.124 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 38.8 mp0 -53.31 149.01 7.83 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.8 1.24 . . . . 0.0 113.402 -174.893 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 . . . . . 0 C--O 1.237 0.397 0 C-N-CA 124.543 1.137 . . . . 0.0 109.667 -178.838 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 17.0 p . . . . . 0 N--CA 1.473 0.704 0 CA-C-O 120.656 0.265 . . . . 0.0 111.185 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -120.85 140.09 52.25 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.97 1.308 . . . . 0.0 110.527 -174.442 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 16.9 m -140.91 156.76 68.47 Favored Pre-proline 0 CA--C 1.547 0.855 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 178.613 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -71.1 155.13 96.94 Favored 'Cis proline' 0 C--N 1.35 0.655 0 N-CA-C 110.367 -0.666 . . . . 0.0 110.367 -12.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.68 -30.19 67.18 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 173.31 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 46.0 tp -138.53 118.86 13.67 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.645 1.578 . . . . 0.0 109.095 170.596 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.4 tp -101.19 126.89 47.95 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.241 1.416 . . . . 0.0 109.229 172.504 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.6 t -109.79 124.54 66.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 171.71 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.8 m -128.09 174.28 11.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 C-N-CA 124.814 1.245 . . . . 0.0 111.284 172.885 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 33.8 m -104.34 151.85 22.96 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.657 1.583 . . . . 0.0 110.281 174.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -45.25 122.87 3.66 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.082 1.753 . . . . 0.0 112.509 171.728 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.27 0.42 89.48 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 125.902 1.715 . . . . 0.0 115.126 -179.011 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -88.08 155.77 19.63 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 119.768 1.784 . . . . 0.0 112.629 177.394 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -76.14 121.83 23.42 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.839 1.256 . . . . 0.0 110.771 173.13 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -101.4 131.45 47.48 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.112 0.965 . . . . 0.0 110.688 175.073 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 21.3 m -132.76 124.96 29.07 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.822 0.849 . . . . 0.0 111.531 -178.708 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -104.96 159.46 15.8 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 126.041 1.736 . . . . 0.0 111.102 170.364 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 32.2 m -120.52 138.59 53.76 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.615 1.566 . . . . 0.0 110.052 177.018 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 74.4 m -128.6 137.5 51.73 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.023 1.329 . . . . 0.0 110.938 169.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 47.6 p -124.89 140.9 52.51 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.39 0.676 . . . . 0.0 109.673 170.268 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 . . . . . 0 N--CA 1.466 0.374 0 N-CA-C 113.988 1.107 . . . . 0.0 113.988 -169.053 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 42.7 p90 . . . . . 0 CA--C 1.539 0.53 0 CA-C-O 121.137 0.494 . . . . 0.0 111.743 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 40.7 t -95.85 125.5 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 N-CA-C 106.487 -1.671 . . . . 0.0 106.487 169.541 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 37.6 tp -99.38 139.33 35.19 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 123.054 0.541 . . . . 0.0 109.647 174.495 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -128.16 137.12 51.94 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.544 1.538 . . . . 0.0 109.997 -176.36 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 68.9 t-105 -98.19 134.93 40.56 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.68 1.192 . . . . 0.0 110.699 173.267 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 90.5 m-85 -124.2 143.42 50.52 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.913 1.285 . . . . 0.0 112.805 -178.794 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 56.8 ttp85 -95.83 142.96 27.48 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 126.542 1.937 . . . . 0.0 107.874 167.157 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 33.1 mtp -91.61 144.89 25.07 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 118.826 0.739 . . . . 0.0 112.206 172.887 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 58.8 m -108.96 149.49 39.67 Favored Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 125.559 1.543 . . . . 0.0 110.85 171.264 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -69.01 -14.88 39.32 Favored 'Trans proline' 0 C--N 1.353 0.784 0 C-N-CA 123.879 3.053 . . . . 0.0 114.482 -171.023 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 6.1 t -76.91 7.92 4.31 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 119.098 0.863 . . . . 0.0 113.153 170.168 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 34.3 m-80 75.6 36.79 0.45 Allowed 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 127.896 2.479 . . . . 0.0 112.039 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -115.84 172.61 7.03 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.176 1.39 . . . . 0.0 111.007 179.743 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.8 p -132.62 152.49 51.63 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 125.842 1.657 . . . . 0.0 111.505 -178.231 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -138.51 125.89 21.77 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.539 1.536 . . . . 0.0 110.927 -177.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -77.64 125.33 29.17 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.138 0.975 . . . . 0.0 111.218 -176.519 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 25.4 mt -102.09 -43.35 5.78 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.894 0.878 . . . . 0.0 112.944 -179.016 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -157.46 168.13 28.22 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.377 1.471 . . . . 0.0 111.455 -172.402 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.66 167.86 27.41 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.44 1.096 . . . . 0.0 112.862 -178.725 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -142.22 126.16 9.84 Favored Pre-proline 0 CA--C 1.543 0.674 0 C-N-CA 124.661 1.185 . . . . 0.0 110.33 169.112 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo . . . . . 0 C--N 1.351 0.677 0 CA-C-N 119.355 0.805 . . . . 0.0 112.725 -10.649 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 5.2 ptm180 . . . . . 0 N--CA 1.47 0.535 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -97.8 125.53 42.69 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.898 1.279 . . . . 0.0 109.33 172.816 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -142.94 152.53 42.11 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.472 1.109 . . . . 0.0 111.945 -169.875 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 49.0 t -126.6 139.85 50.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.116 0 C-N-CA 124.856 1.262 . . . . 0.0 111.021 176.441 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 97.4 m -123.38 128.89 50.51 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.538 1.535 . . . . 0.0 109.509 170.046 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 37.2 tt0 -85.9 137.74 32.53 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.887 0.875 . . . . 0.0 110.149 170.396 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 34.3 mt -91.1 157.31 43.14 Favored Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 124.357 1.063 . . . . 0.0 111.894 -179.051 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -66.75 -3.85 10.08 Favored 'Trans proline' 0 CA--C 1.542 0.91 0 C-N-CA 123.664 2.91 . . . . 0.0 114.028 174.748 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -66.59 -13.66 61.37 Favored 'General case' 0 CA--C 1.555 1.147 0 CA-C-N 119.378 0.99 . . . . 0.0 112.951 170.684 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 92.32 -24.57 21.85 Favored Glycine 0 N--CA 1.476 1.307 0 C-N-CA 125.916 1.722 . . . . 0.0 115.716 168.937 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 11.5 ptp180 -154.5 73.64 0.92 Allowed 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.534 1.534 . . . . 0.0 109.695 172.028 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -168.89 137.0 2.01 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 128.074 2.55 . . . . 0.0 107.273 -171.458 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 55.1 m-85 -148.78 146.58 28.09 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -167.606 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 4.8 m-70 -106.03 132.5 52.04 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.283 1.433 . . . . 0.0 111.116 168.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 2.6 mpp? -112.1 120.31 41.4 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 126.361 1.864 . . . . 0.0 109.365 177.228 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 36.0 m -116.22 130.89 57.01 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.322 1.049 . . . . 0.0 112.211 -169.849 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 58.1 t -105.66 110.79 32.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 125.775 1.63 . . . . 0.0 107.13 168.884 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 96.8 t -76.29 123.44 32.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.495 1.118 . . . . 0.0 109.55 178.547 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 53.63 73.43 0.38 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.053 1.741 . . . . 0.0 111.574 177.047 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.87 132.26 44.15 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.195 0.998 . . . . 0.0 111.269 -179.136 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -106.94 161.65 14.53 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 126.198 1.799 . . . . 0.0 110.104 177.727 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -50.68 -35.79 32.69 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 119.292 0.951 . . . . 0.0 113.377 -178.011 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -62.88 -21.1 65.74 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 125.564 1.546 . . . . 0.0 115.003 176.585 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -76.4 -11.87 59.96 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 119.69 1.132 . . . . 0.0 113.116 177.707 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.9 m -62.93 131.08 47.5 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 120.617 -1.302 . . . . 0.0 112.349 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 156.99 -168.77 34.04 Favored Glycine 0 N--CA 1.472 1.055 0 C-N-CA 124.381 0.991 . . . . 0.0 113.703 -173.505 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.2 m -95.8 142.48 28.03 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.623 1.169 . . . . 0.0 111.219 -175.678 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -146.1 160.91 41.27 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.149 1.78 . . . . 0.0 111.071 -177.414 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -161.77 169.07 22.08 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 120.871 -1.143 . . . . 0.0 113.99 -175.474 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 6.4 m -107.06 148.26 28.96 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.178 1.391 . . . . 0.0 112.356 175.414 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -145.66 135.77 6.1 Favored Glycine 0 N--CA 1.469 0.859 0 C-N-CA 125.02 1.295 . . . . 0.0 111.523 169.2 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -113.96 157.28 22.65 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.008 0.923 . . . . 0.0 112.82 -176.013 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 19.7 tt -143.41 131.49 18.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 125.141 1.377 . . . . 0.0 110.226 172.377 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 15.3 m -68.27 161.61 26.88 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.179 1.392 . . . . 0.0 114.152 -171.834 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.9 -10.92 32.36 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 116.119 1.896 . . . . 0.0 116.119 -176.576 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -81.47 149.83 65.76 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.766 1.227 . . . . 0.0 112.427 -178.496 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -68.09 -21.5 42.63 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 123.038 2.492 . . . . 0.0 112.699 175.59 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 1.9 tppp? -81.52 -4.07 54.93 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 125.217 1.407 . . . . 0.0 113.66 177.198 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.5 164.69 13.5 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.813 1.245 . . . . 0.0 113.986 -175.47 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 38.0 tt0 -152.44 141.25 21.02 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.228 1.811 . . . . 0.0 108.437 -178.067 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 60.7 mt -59.62 140.5 17.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 124.189 0.996 . . . . 0.0 112.227 -172.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 32.5 mmtm -125.74 124.33 40.8 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.743 1.617 . . . . 0.0 110.306 169.36 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -147.74 141.92 26.12 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.119 1.767 . . . . 0.0 110.93 -174.417 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 8.4 t -173.35 156.65 3.14 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 126.259 1.824 . . . . 0.0 109.982 -179.332 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.1 mp 68.94 173.88 0.29 Allowed 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 127.293 2.237 . . . . 0.0 111.209 -169.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -159.63 168.22 26.57 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.611 1.564 . . . . 0.0 112.49 173.6 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -128.93 161.62 29.46 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 126.946 2.098 . . . . 0.0 110.892 173.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -116.53 139.28 50.66 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.802 1.241 . . . . 0.0 111.081 -178.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 54.4 tp -108.82 132.8 53.65 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 125.684 1.593 . . . . 0.0 109.929 171.3 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 66.2 ttt180 -122.49 119.38 30.75 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.901 1.68 . . . . 0.0 109.153 169.707 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 38.6 t -104.64 115.27 46.22 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 124.211 1.004 . . . . 0.0 108.557 171.141 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 80.8 p -87.58 153.3 21.5 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.004 1.721 . . . . 0.0 110.144 177.559 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 4.2 pm0 -66.52 154.58 39.98 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.696 0.798 . . . . 0.0 112.884 -178.517 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 19.8 tpt180 . . . . . 0 N--CA 1.466 0.37 0 C-N-CA 123.99 0.916 . . . . 0.0 109.646 -173.152 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.5 t . . . . . 0 N--CA 1.467 0.417 0 CA-C-O 121.723 0.773 . . . . 0.0 112.191 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 82.8 t80 -145.45 118.06 8.6 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 127.419 2.288 . . . . 0.0 108.732 -175.328 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 97.8 p -140.84 161.56 53.38 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 124.808 1.243 . . . . 0.0 113.645 -168.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -67.67 161.53 78.85 Favored 'Cis proline' 0 C--N 1.355 0.886 0 CA-C-N 120.041 1.051 . . . . 0.0 111.707 -4.94 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.64 -24.75 67.76 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 176.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 13.5 tp -139.71 121.04 14.94 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 126.015 1.726 . . . . 0.0 108.487 171.198 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 61.3 tp -109.67 121.35 45.01 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.38 1.072 . . . . 0.0 108.591 168.916 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 14.3 p -109.95 126.46 67.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 123.867 0.867 . . . . 0.0 109.779 171.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 27.0 m -130.77 165.77 30.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 125.006 1.323 . . . . 0.0 111.964 176.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.3 m -89.44 147.8 23.81 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.748 1.219 . . . . 0.0 110.489 172.055 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -52.85 125.99 18.76 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.483 1.113 . . . . 0.0 111.393 174.947 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 91.06 -2.44 79.25 Favored Glycine 0 CA--C 1.534 1.231 0 C-N-CA 125.305 1.431 . . . . 0.0 114.75 -176.319 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -87.04 157.19 19.48 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 119.704 1.752 . . . . 0.0 112.275 175.531 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 53.6 m-20 -90.24 104.45 17.02 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.2 1.0 . . . . 0.0 110.234 178.44 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -90.27 111.87 23.21 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.843 0.857 . . . . 0.0 111.583 -171.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 25.8 m -113.61 125.13 53.83 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 118.716 0.689 . . . . 0.0 112.318 -173.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -101.89 159.59 15.21 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 127.094 2.158 . . . . 0.0 110.229 169.745 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.0 m -112.39 132.89 54.78 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.011 1.324 . . . . 0.0 109.847 174.149 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 43.1 t -117.51 144.4 45.11 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.765 1.626 . . . . 0.0 111.336 171.451 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 46.8 t -147.08 141.51 26.41 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.361 -0.837 . . . . 0.0 111.756 173.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 . . . . . 0 N--CA 1.467 0.395 0 C-N-CA 126.529 1.932 . . . . 0.0 113.948 -176.472 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 53.2 p90 . . . . . 0 CA--C 1.537 0.464 0 CA-C-O 121.028 0.442 . . . . 0.0 111.48 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 49.1 t -96.07 128.7 47.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 C-N-CA 125.224 1.409 . . . . 0.0 107.68 173.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -112.95 122.02 46.38 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.433 1.493 . . . . 0.0 109.006 -175.166 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 11.4 m-80 -122.57 158.53 29.71 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.369 1.467 . . . . 0.0 112.788 -168.166 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 10.0 t90 -124.18 137.69 54.51 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 125.311 1.444 . . . . 0.0 112.068 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -132.99 141.09 48.11 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.786 1.234 . . . . 0.0 113.077 -176.807 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.5 ttt-85 -101.14 140.93 34.74 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.393 1.477 . . . . 0.0 108.258 168.096 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 29.8 mtp -91.98 145.92 24.15 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 119.04 0.836 . . . . 0.0 111.978 178.046 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 67.4 m -96.64 158.95 32.8 Favored Pre-proline 0 CA--C 1.549 0.906 0 C-N-CA 124.369 1.068 . . . . 0.0 112.064 174.099 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -56.57 -34.26 94.9 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 123.944 3.096 . . . . 0.0 113.654 174.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 9.6 m -77.01 18.03 0.4 Allowed 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.617 1.567 . . . . 0.0 113.529 175.82 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . 0.318 13.6 p30 58.01 21.04 7.37 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 128.263 2.625 . . . . 0.0 115.623 -176.596 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 18.7 mm100 -82.98 -178.06 6.99 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.052 0.941 . . . . 0.0 110.556 169.089 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -148.65 141.99 25.18 Favored 'General case' 0 CA--C 1.518 -0.271 0 C-N-CA 127.185 2.194 . . . . 0.0 108.546 -171.399 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -127.27 120.06 27.77 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 125.846 1.659 . . . . 0.0 109.359 -172.82 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 57.8 tttm -76.92 117.02 18.1 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.888 1.275 . . . . 0.0 110.868 -176.1 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 37.2 mt -94.45 -50.04 5.4 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.834 1.254 . . . . 0.0 112.966 -168.427 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -171.23 170.46 6.03 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.74 2.016 . . . . 0.0 110.33 -169.684 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.69 165.53 32.41 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.588 1.155 . . . . 0.0 112.963 -176.46 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -129.93 130.21 23.12 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 125.95 1.7 . . . . 0.0 109.268 169.009 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo . . . . . 0 C--N 1.351 0.67 0 CA-C-N 120.359 1.164 . . . . 0.0 112.734 -7.026 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 89.6 mtt180 . . . . . 0 N--CA 1.471 0.597 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -85.69 122.03 29.21 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.477 1.111 . . . . 0.0 111.966 -169.448 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -140.32 140.55 35.65 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.967 1.307 . . . . 0.0 110.539 -173.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.5 t -126.52 130.87 71.77 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 124.922 1.289 . . . . 0.0 110.01 -177.879 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 89.7 m -130.17 127.99 40.84 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.933 1.293 . . . . 0.0 110.427 -179.121 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -79.97 140.11 36.76 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.114 0.965 . . . . 0.0 110.997 173.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 27.1 mt -97.63 159.32 31.33 Favored Pre-proline 0 CA--C 1.546 0.827 0 C-N-CA 125.056 1.342 . . . . 0.0 111.487 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -67.0 -3.68 10.11 Favored 'Trans proline' 0 CA--C 1.543 0.944 0 C-N-CA 123.681 2.921 . . . . 0.0 114.351 175.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -69.05 -8.86 49.06 Favored 'General case' 0 CA--C 1.557 1.243 0 CA-C-N 119.364 0.983 . . . . 0.0 113.277 172.445 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 90.01 -34.08 4.23 Favored Glycine 0 N--CA 1.476 1.351 0 C-N-CA 126.439 1.971 . . . . 0.0 115.971 168.484 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 78.9 mtt85 -140.06 73.61 1.43 Allowed 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.862 1.265 . . . . 0.0 109.11 169.724 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -165.79 136.06 3.54 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 125.649 1.58 . . . . 0.0 108.577 -171.818 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -146.89 131.46 17.77 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.96 0.904 . . . . 0.0 111.734 -167.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 5.0 m-70 -94.53 133.87 37.69 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.743 0.817 . . . . 0.0 110.7 169.035 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 32.1 mtt -123.44 105.31 9.69 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 126.387 1.875 . . . . 0.0 109.242 -174.433 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 7.2 t -112.83 128.91 56.57 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -169.676 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 15.2 t -92.86 90.09 2.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 106.588 -1.634 . . . . 0.0 106.588 168.33 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 72.5 t -64.84 131.34 30.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 123.451 0.7 . . . . 0.0 109.236 177.089 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 3.5 tpp180 62.81 45.78 5.5 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.786 1.235 . . . . 0.0 112.136 173.215 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.33 138.12 58.42 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.583 -0.698 . . . . 0.0 112.724 -169.457 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 51.8 mmm-85 -116.42 163.76 15.57 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 126.178 1.791 . . . . 0.0 110.39 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 33.2 mtm105 -55.39 -25.42 35.5 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 179.339 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -71.72 -18.82 62.12 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 174.617 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -79.72 -27.37 40.62 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 119.736 1.153 . . . . 0.0 112.329 177.868 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 50.8 m -49.47 139.79 11.53 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.822 1.249 . . . . 0.0 113.152 179.567 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 147.22 -167.15 28.47 Favored Glycine 0 N--CA 1.472 1.055 0 C-N-CA 124.535 1.064 . . . . 0.0 113.089 -174.754 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.7 m -91.93 148.17 22.41 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.996 1.318 . . . . 0.0 110.833 -177.243 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 65.7 m-85 -147.41 157.95 43.78 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.907 1.683 . . . . 0.0 112.083 -174.139 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -158.4 159.27 35.58 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.993 1.317 . . . . 0.0 113.492 175.819 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 49.7 t -104.03 148.6 26.03 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.257 1.823 . . . . 0.0 111.255 178.523 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -151.77 136.44 5.48 Favored Glycine 0 N--CA 1.474 1.179 0 C-N-CA 123.743 0.687 . . . . 0.0 114.308 177.776 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -113.84 155.68 25.27 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.74 1.216 . . . . 0.0 113.046 -176.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 18.5 tt -146.51 132.79 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 125.316 1.446 . . . . 0.0 110.436 172.773 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 16.4 m -72.46 161.13 31.23 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.529 1.131 . . . . 0.0 112.954 -178.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.58 -10.13 49.09 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 115.946 1.832 . . . . 0.0 115.946 -178.515 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -71.52 147.55 92.53 Favored Pre-proline 0 CA--C 1.549 0.926 0 C-N-CA 124.241 1.016 . . . . 0.0 112.303 -178.859 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -67.57 -21.89 45.34 Favored 'Trans proline' 0 CA--C 1.538 0.725 0 C-N-CA 122.982 2.455 . . . . 0.0 112.807 177.806 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -85.99 -0.82 56.45 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 124.874 1.269 . . . . 0.0 113.893 176.868 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.9 157.17 31.33 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.245 1.018 . . . . 0.0 113.094 -177.027 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 84.6 mt-30 -138.0 158.62 43.96 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.118 1.767 . . . . 0.0 108.916 175.783 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 57.9 mt -78.23 118.27 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 121.745 -0.597 . . . . 0.0 110.578 -175.853 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 3.8 ttmp? -94.19 131.43 39.76 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.272 1.429 . . . . 0.0 109.12 169.321 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -114.51 149.74 35.94 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.18 0.992 . . . . 0.0 112.504 -170.182 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 51.7 m -88.37 164.97 15.27 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.295 1.438 . . . . 0.0 113.132 174.829 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -66.7 139.52 57.84 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.566 0.746 . . . . 0.0 109.408 168.753 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.55 166.62 23.29 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 -173.879 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -142.28 169.6 17.27 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 127.227 2.211 . . . . 0.0 110.668 172.498 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -116.74 144.69 44.15 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 174.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 66.9 tp -102.67 135.91 43.44 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 127.141 2.176 . . . . 0.0 109.224 169.532 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 35.3 ttm180 -131.6 108.54 9.6 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.339 1.456 . . . . 0.0 109.503 -179.744 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 35.9 t -99.82 115.22 40.35 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 124.198 0.999 . . . . 0.0 109.064 176.604 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 82.8 p -97.03 154.88 17.05 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.891 1.676 . . . . 0.0 110.664 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -63.09 142.49 58.36 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.304 0.642 . . . . 0.0 112.455 -176.177 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 48.7 ttt85 . . . . . 0 N--CA 1.467 0.407 0 C-N-CA 123.87 0.868 . . . . 0.0 110.826 -179.087 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.1 t . . . . . 0 C--O 1.237 0.434 0 CA-C-O 121.276 0.56 . . . . 0.0 111.055 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -120.7 114.27 21.42 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 126.079 1.752 . . . . 0.0 106.819 171.145 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 67.6 m -130.94 151.99 79.89 Favored Pre-proline 0 N--CA 1.475 0.811 0 N-CA-C 114.144 1.165 . . . . 0.0 114.144 -169.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -68.55 152.52 89.0 Favored 'Cis proline' 0 C--N 1.353 0.779 0 CA-C-N 118.79 0.604 . . . . 0.0 111.257 -4.445 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -55.94 -28.63 57.76 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 176.394 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 45.1 tp -137.16 114.46 10.88 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.46 1.504 . . . . 0.0 108.302 168.824 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 44.7 tp -96.74 126.62 42.03 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.96 1.304 . . . . 0.0 109.187 173.194 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.7 t -111.77 122.84 66.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 124.142 0.977 . . . . 0.0 108.472 172.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 33.6 m -126.54 167.98 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 124.347 1.059 . . . . 0.0 111.997 174.82 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 22.7 m -91.12 146.64 23.67 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.779 1.232 . . . . 0.0 110.128 172.188 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -52.41 120.15 5.25 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.469 1.108 . . . . 0.0 111.78 174.862 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 97.86 -1.58 59.71 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 126.083 1.801 . . . . 0.0 114.804 -177.342 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -89.62 155.06 19.49 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 119.556 1.678 . . . . 0.0 112.556 178.416 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 66.8 m-20 -83.21 106.08 14.71 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.012 0.925 . . . . 0.0 110.182 177.487 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -89.66 111.9 22.99 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.841 0.856 . . . . 0.0 110.872 -176.798 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 33.8 m -120.08 125.53 48.51 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.961 0.904 . . . . 0.0 111.496 -175.289 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -96.98 146.92 24.51 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 126.05 1.74 . . . . 0.0 110.684 170.014 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 88.4 m -94.17 123.92 37.86 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.003 1.321 . . . . 0.0 108.081 169.279 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 37.2 t -122.74 122.6 39.13 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.878 1.671 . . . . 0.0 109.774 -176.281 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 42.4 t -143.74 127.5 17.2 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 121.45 -0.781 . . . . 0.0 111.067 -169.879 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 33.6 p90 . . . . . 0 CA--C 1.537 0.448 0 C-N-CA 125.472 1.509 . . . . 0.0 111.653 169.861 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 32.5 p90 . . . . . 0 CA--C 1.537 0.473 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 91.4 t -96.19 134.22 34.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 C-N-CA 126.216 1.806 . . . . 0.0 108.616 169.384 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -100.39 128.31 46.49 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.246 1.019 . . . . 0.0 108.427 168.842 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 28.3 m120 -120.48 157.14 30.03 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.513 1.925 . . . . 0.0 111.423 -176.076 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 17.1 t90 -135.03 143.76 46.92 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.32 1.048 . . . . 0.0 112.821 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -141.4 148.51 39.69 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.907 1.283 . . . . 0.0 114.097 -169.821 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 59.1 ttt85 -104.45 143.21 33.32 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.453 1.501 . . . . 0.0 108.172 167.544 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 33.8 mtp -86.49 145.07 26.96 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.354 0.979 . . . . 0.0 112.388 174.356 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 74.1 m -107.4 152.19 41.19 Favored Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 125.612 1.565 . . . . 0.0 111.478 177.096 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -68.57 -17.35 43.23 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 124.102 3.201 . . . . 0.0 113.608 -175.525 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.3 m -76.92 9.09 3.14 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.849 1.26 . . . . 0.0 113.005 171.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 58.9 t30 69.63 46.51 0.71 Allowed 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 127.402 2.281 . . . . 0.0 111.901 178.802 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -137.72 -172.61 3.28 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.077 1.351 . . . . 0.0 110.922 176.823 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.2 p -138.05 151.05 47.48 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 125.847 1.659 . . . . 0.0 110.474 -172.769 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -127.76 131.8 49.62 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 124.878 1.271 . . . . 0.0 111.224 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -78.44 118.84 20.98 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.316 1.447 . . . . 0.0 111.404 -172.058 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 86.1 mt -97.41 -51.12 4.27 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.773 1.229 . . . . 0.0 112.278 -170.46 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -168.51 171.32 9.04 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.748 1.619 . . . . 0.0 109.858 -174.461 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.51 163.06 35.54 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.803 1.241 . . . . 0.0 111.351 -176.276 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 38.9 t80 -138.07 116.22 9.54 Favored Pre-proline 0 CA--C 1.546 0.818 0 C-N-CA 124.032 0.933 . . . . 0.0 110.543 169.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo . . . . . 0 CA--C 1.539 0.765 0 CA-C-N 119.286 0.781 . . . . 0.0 111.379 -8.553 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 66.2 mtt85 . . . . . 0 N--CA 1.469 0.505 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -83.08 132.37 35.12 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 -165.766 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -143.82 141.31 30.31 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.384 1.474 . . . . 0.0 111.746 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 89.8 t -123.72 129.1 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 C-N-CA 125.552 1.541 . . . . 0.0 109.065 170.201 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 89.0 m -129.86 131.44 46.1 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.155 1.382 . . . . 0.0 110.074 -179.255 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -82.93 135.92 34.74 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.947 0.899 . . . . 0.0 110.359 173.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 33.2 mt -88.31 163.02 38.25 Favored Pre-proline 0 CA--C 1.547 0.842 0 C-N-CA 123.569 0.748 . . . . 0.0 111.987 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.74 -22.93 38.83 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 123.996 3.131 . . . . 0.0 114.009 170.347 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 58.5 t30 -65.14 -12.19 48.3 Favored 'General case' 0 CA--C 1.555 1.173 0 C-N-CA 124.26 1.024 . . . . 0.0 113.445 175.176 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 78.25 -34.11 1.76 Allowed Glycine 0 N--CA 1.476 1.351 0 C-N-CA 127.677 2.56 . . . . 0.0 116.352 168.432 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 2.5 ppt_? -130.13 73.47 1.53 Allowed 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 123.512 1.625 . . . . 0.0 108.32 171.678 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 11.1 t0 179.76 136.91 0.11 Allowed 'General case' 0 C--O 1.238 0.485 0 C-N-CA 128.515 2.726 . . . . 0.0 108.415 -169.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -145.85 148.51 32.95 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 124.222 1.009 . . . . 0.0 112.35 -168.705 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 14.2 m170 -105.68 123.59 48.17 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.079 1.352 . . . . 0.0 111.099 169.557 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -110.96 111.3 22.33 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 126.813 2.045 . . . . 0.0 108.01 -178.106 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 8.4 t -123.7 134.3 53.73 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 115.317 1.599 . . . . 0.0 115.317 -168.248 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 25.7 t -99.33 93.57 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 126.42 1.888 . . . . 0.0 106.153 167.358 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 98.0 t -66.9 127.23 28.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 124.882 1.273 . . . . 0.0 109.536 178.439 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 68.8 ttt180 57.65 55.68 5.4 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.767 1.627 . . . . 0.0 111.653 178.747 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -72.56 140.53 48.15 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.001 0.92 . . . . 0.0 112.616 -172.923 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 60.6 mtp85 -129.32 168.53 16.11 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.766 1.626 . . . . 0.0 110.26 -174.345 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 51.5 mtm180 -61.84 -17.58 56.88 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 115.598 1.703 . . . . 0.0 115.598 -169.133 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -71.37 -22.84 61.84 Favored 'General case' 0 CA--C 1.553 1.064 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 169.418 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 -86.55 -13.54 45.56 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 125.377 1.471 . . . . 0.0 113.574 -176.397 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 41.4 m -55.61 137.82 48.29 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 120.986 -1.071 . . . . 0.0 111.183 169.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 151.61 -165.98 30.65 Favored Glycine 0 N--CA 1.471 0.97 0 O-C-N 121.445 -0.785 . . . . 0.0 113.504 -176.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.9 m -98.5 140.83 32.16 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.879 1.272 . . . . 0.0 110.895 -172.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -140.26 154.12 46.75 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.084 1.354 . . . . 0.0 112.568 -175.248 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.3 pp -158.35 153.99 26.32 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.944 1.298 . . . . 0.0 112.778 179.201 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 14.4 m -95.47 159.91 14.77 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.604 0.761 . . . . 0.0 112.121 172.223 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -143.8 175.26 23.82 Favored Glycine 0 CA--C 1.527 0.823 0 C-N-CA 125.35 1.452 . . . . 0.0 111.56 168.542 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -158.54 159.24 35.33 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 118.635 1.217 . . . . 0.0 113.96 -178.768 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 16.9 tt -150.22 138.94 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 125.417 1.487 . . . . 0.0 110.564 177.529 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 13.5 m -69.51 159.67 32.88 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.321 1.048 . . . . 0.0 112.668 176.39 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 40.9 mt -75.17 -11.87 60.17 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 177.902 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -65.59 148.78 97.93 Favored Pre-proline 0 CA--C 1.552 1.029 0 C-N-CA 124.405 1.082 . . . . 0.0 112.367 175.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -69.47 -20.19 36.55 Favored 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 123.141 2.561 . . . . 0.0 113.194 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -87.23 3.64 45.75 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.715 1.206 . . . . 0.0 113.886 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -67.31 164.56 18.18 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.871 1.268 . . . . 0.0 113.957 -175.145 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 22.1 pt20 -149.1 163.5 37.4 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.417 1.887 . . . . 0.0 109.756 176.28 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 54.8 mt -83.83 135.78 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 CA-C-O 121.554 0.693 . . . . 0.0 112.744 -171.356 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -95.99 144.67 26.08 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 127.502 2.321 . . . . 0.0 109.74 167.676 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.9 mp0 -143.03 158.82 43.24 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 126.543 1.937 . . . . 0.0 109.801 170.589 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 4.1 t -150.08 -170.35 3.62 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 175.07 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -61.5 130.68 47.17 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.13 1.772 . . . . 0.0 114.109 -169.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.73 167.18 22.31 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 115.872 1.804 . . . . 0.0 115.872 -169.881 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -123.27 169.67 11.06 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 127.33 2.252 . . . . 0.0 110.812 169.428 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -126.64 143.97 51.06 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.994 1.318 . . . . 0.0 111.846 -177.607 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 49.8 tp -114.08 136.7 52.64 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 126.354 1.861 . . . . 0.0 110.293 173.373 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 59.6 ttt85 -127.49 123.37 35.78 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 126.171 1.788 . . . . 0.0 109.944 170.629 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 44.9 t -102.96 123.57 56.45 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 124.612 1.165 . . . . 0.0 108.679 169.535 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 79.6 p -99.77 158.64 15.64 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.744 1.618 . . . . 0.0 110.882 176.49 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -58.52 150.85 21.69 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.421 1.088 . . . . 0.0 112.894 -178.273 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 11.9 ttm180 . . . . . 0 C--O 1.237 0.416 0 C-N-CA 123.695 0.798 . . . . 0.0 109.982 -174.619 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 33.7 m . . . . . 0 N--CA 1.471 0.621 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -143.28 117.91 9.81 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.671 1.589 . . . . 0.0 109.043 179.694 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 88.6 p -140.94 159.89 60.36 Favored Pre-proline 0 CA--C 1.551 0.994 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 -168.398 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.3 162.51 79.31 Favored 'Cis proline' 0 C--N 1.356 0.925 0 CA-C-N 120.058 1.057 . . . . 0.0 111.912 -3.141 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.74 -24.05 67.61 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 177.487 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 47.9 tp -142.0 124.15 15.49 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 125.341 1.457 . . . . 0.0 108.658 169.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 53.7 tp -111.25 126.57 55.02 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.064 1.346 . . . . 0.0 109.255 171.678 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.2 t -111.51 122.57 66.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.966 0.907 . . . . 0.0 109.252 175.159 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.1 m -126.63 173.24 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 125.132 1.373 . . . . 0.0 111.342 170.015 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 99.1 m -104.84 151.79 23.4 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.49 1.516 . . . . 0.0 110.228 172.6 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -51.77 125.56 15.38 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.281 1.032 . . . . 0.0 112.562 174.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.84 -3.46 74.07 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 126.054 1.788 . . . . 0.0 114.531 -176.315 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -92.61 154.37 18.43 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 119.594 1.697 . . . . 0.0 111.523 175.033 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -85.17 127.39 34.25 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 121.505 0.669 . . . . 0.0 111.305 171.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -103.83 128.13 51.29 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.737 1.615 . . . . 0.0 110.083 178.04 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 27.7 m -128.66 127.87 43.02 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.064 0.945 . . . . 0.0 111.371 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -103.28 158.83 16.05 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.553 1.941 . . . . 0.0 110.59 170.511 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 85.5 m -101.2 134.21 44.59 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.058 1.343 . . . . 0.0 109.261 169.776 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 44.8 t -115.16 134.06 55.49 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.432 1.893 . . . . 0.0 110.011 170.797 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 66.8 m -138.69 130.34 27.63 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.194 0.997 . . . . 0.0 111.042 -173.463 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 40.9 p90 . . . . . 0 CA--C 1.537 0.469 0 C-N-CA 125.494 1.518 . . . . 0.0 110.535 179.428 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 40.8 p90 . . . . . 0 CA--C 1.538 0.5 0 CA-C-O 120.993 0.425 . . . . 0.0 111.924 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 87.7 t -111.03 128.43 67.48 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 C-N-CA 125.612 1.565 . . . . 0.0 108.075 169.836 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 58.8 tp -106.37 134.05 50.11 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 125.243 1.417 . . . . 0.0 108.883 169.788 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -127.16 150.47 49.49 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.152 1.381 . . . . 0.0 110.825 178.033 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 11.7 t90 -117.62 139.99 50.24 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.473 1.109 . . . . 0.0 111.236 176.155 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -133.29 146.86 51.77 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.703 1.201 . . . . 0.0 113.626 -172.855 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -111.07 138.67 47.19 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.608 1.563 . . . . 0.0 108.276 168.042 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 28.3 mtp -85.05 143.62 28.77 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 118.846 0.748 . . . . 0.0 112.339 -178.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.4 m -100.43 154.05 37.41 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 125.212 1.405 . . . . 0.0 111.918 178.712 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.83 -30.98 79.17 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 124.442 3.428 . . . . 0.0 114.704 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.0 m -77.0 10.74 2.13 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.079 1.352 . . . . 0.0 113.593 178.454 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 66.38 43.6 2.63 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.775 2.03 . . . . 0.0 111.353 -176.316 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 -121.55 -172.73 2.48 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.551 1.541 . . . . 0.0 109.88 175.89 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.1 p -144.74 144.23 31.09 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.638 1.575 . . . . 0.0 110.609 -173.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -121.54 132.43 54.7 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.721 1.208 . . . . 0.0 111.347 176.565 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -77.66 128.27 33.82 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.866 1.266 . . . . 0.0 111.335 -177.334 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 60.0 mt -104.7 -44.5 4.85 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.196 1.398 . . . . 0.0 113.544 -168.511 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -171.27 174.93 4.38 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 128.085 2.554 . . . . 0.0 109.395 -174.908 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.6 166.57 30.45 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.314 1.046 . . . . 0.0 112.769 -170.229 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -142.89 115.25 6.03 Favored Pre-proline 0 CA--C 1.546 0.821 0 C-N-CA 125.435 1.494 . . . . 0.0 109.67 169.506 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo . . . . . 0 C--N 1.351 0.705 0 CA-C-N 119.941 1.015 . . . . 0.0 112.665 -10.75 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 13.0 ptp180 . . . . . 0 N--CA 1.473 0.695 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -93.99 140.02 30.22 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.32 1.448 . . . . 0.0 111.339 -176.104 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -137.86 145.27 41.99 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.298 1.439 . . . . 0.0 111.123 178.927 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 58.1 t -126.54 125.23 66.87 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 125.538 1.535 . . . . 0.0 108.734 174.024 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 84.8 m -130.49 129.28 42.72 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.818 1.247 . . . . 0.0 110.655 -174.178 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.7 pm0 -76.61 141.32 41.1 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.792 1.237 . . . . 0.0 111.605 175.421 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 38.0 mt -93.92 157.82 37.34 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 123.829 0.852 . . . . 0.0 111.628 177.061 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -65.71 -3.56 8.24 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 123.551 2.834 . . . . 0.0 114.028 174.844 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -62.41 -26.14 68.33 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 119.441 1.018 . . . . 0.0 112.739 169.519 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 92.34 -15.7 61.6 Favored Glycine 0 N--CA 1.474 1.226 0 C-N-CA 125.659 1.599 . . . . 0.0 114.547 175.516 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.41 73.51 0.91 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.769 1.628 . . . . 0.0 109.995 170.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -174.64 147.43 1.06 Allowed 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 127.223 2.209 . . . . 0.0 109.054 -177.344 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 60.6 m-85 -143.62 151.29 39.96 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 114.103 1.149 . . . . 0.0 114.103 -168.325 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 13.5 m170 -110.01 139.32 45.25 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.684 1.594 . . . . 0.0 109.625 167.267 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 46.1 mtt -128.84 123.73 33.53 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.896 1.278 . . . . 0.0 109.212 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 88.9 p -130.48 139.12 50.54 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 115.739 1.755 . . . . 0.0 115.739 -168.826 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 15.5 t -98.11 104.02 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 125.922 1.689 . . . . 0.0 106.656 169.6 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 60.7 t -81.48 128.67 38.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 123.647 0.779 . . . . 0.0 109.868 -176.417 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 50.1 ttt85 56.23 53.62 8.7 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.224 1.41 . . . . 0.0 111.017 178.812 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.43 145.83 55.64 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.614 1.166 . . . . 0.0 112.106 -170.933 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 33.8 mmm-85 -118.92 168.05 11.15 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.884 1.674 . . . . 0.0 110.489 178.151 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 44.3 mtm180 -57.78 -20.54 36.08 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 120.862 -1.149 . . . . 0.0 113.738 173.845 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -59.57 -22.86 62.34 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.248 1.419 . . . . 0.0 113.893 168.751 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -94.92 -13.28 25.54 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.214 1.406 . . . . 0.0 114.435 -175.152 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 67.2 m -60.71 134.89 57.53 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-N 120.349 1.431 . . . . 0.0 112.616 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 155.92 -165.78 32.76 Favored Glycine 0 N--CA 1.473 1.139 0 O-C-N 121.247 -0.908 . . . . 0.0 113.571 -177.19 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.0 m -95.98 139.61 31.93 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.501 1.12 . . . . 0.0 110.747 -177.356 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 61.3 m-85 -137.41 156.39 48.25 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.074 1.75 . . . . 0.0 112.558 -176.358 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -161.96 147.85 13.39 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.797 1.639 . . . . 0.0 112.134 176.319 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 24.7 p -94.46 159.16 15.23 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.698 0.799 . . . . 0.0 112.655 169.677 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -148.07 131.48 3.84 Favored Glycine 0 CA--C 1.529 0.91 0 C-N-CA 124.766 1.174 . . . . 0.0 112.639 173.248 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -115.11 147.41 40.26 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.563 1.145 . . . . 0.0 112.634 -176.846 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 18.6 tt -148.14 136.38 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 125.189 1.396 . . . . 0.0 111.007 178.333 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 31.5 m -72.15 155.38 40.32 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 121.101 -0.999 . . . . 0.0 111.853 174.608 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.68 -10.78 58.34 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 115.775 1.769 . . . . 0.0 115.775 -174.708 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -75.27 140.63 73.0 Favored Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 124.137 0.975 . . . . 0.0 111.935 179.262 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -55.28 -23.43 37.39 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 123.875 3.05 . . . . 0.0 114.797 174.38 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -71.2 -13.91 62.08 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 124.968 1.307 . . . . 0.0 114.099 177.617 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -74.73 161.47 29.6 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.24 1.416 . . . . 0.0 113.839 -176.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 28.5 mp0 -132.41 156.99 45.68 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.379 1.872 . . . . 0.0 108.573 170.755 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 33.7 mt -75.91 116.38 18.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 O-C-N 121.731 -0.606 . . . . 0.0 109.98 178.645 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.3 88.47 4.94 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.026 0.93 . . . . 0.0 109.358 169.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -77.38 131.32 37.99 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.466 1.106 . . . . 0.0 110.911 179.466 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 76.8 p -81.42 166.91 19.97 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 115.333 1.605 . . . . 0.0 115.333 -174.021 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 10.1 mp -67.29 114.5 6.05 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.103 0.961 . . . . 0.0 109.271 171.258 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.06 150.89 44.44 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -173.025 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -131.83 169.65 15.95 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 126.422 1.889 . . . . 0.0 112.442 178.251 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -110.89 139.66 46.03 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.078 1.351 . . . . 0.0 112.333 -177.771 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 59.6 tp -109.0 128.02 54.58 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 126.063 1.745 . . . . 0.0 108.938 168.789 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -118.77 117.01 27.74 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.494 1.518 . . . . 0.0 109.53 173.185 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 34.9 t -102.58 117.83 48.55 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 C-N-CA 124.347 1.059 . . . . 0.0 108.563 169.561 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 81.6 p -95.96 156.95 16.12 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.895 1.678 . . . . 0.0 111.304 -178.676 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -59.05 142.32 51.65 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.45 1.1 . . . . 0.0 113.224 -171.502 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? . . . . . 0 N--CA 1.467 0.385 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 172.805 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 6.4 t . . . . . 0 N--CA 1.471 0.598 0 CA-C-O 121.228 0.537 . . . . 0.0 112.206 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -148.07 116.74 6.66 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.997 2.119 . . . . 0.0 109.232 -175.454 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 73.0 m -140.82 160.65 57.77 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 124.621 1.168 . . . . 0.0 113.17 -169.77 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -71.53 156.34 97.09 Favored 'Cis proline' 0 C--N 1.352 0.75 0 CA-C-N 119.535 0.87 . . . . 0.0 111.305 -5.182 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.44 -20.09 64.16 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 176.029 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 36.2 tp -141.9 120.16 12.25 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.642 1.577 . . . . 0.0 108.874 169.726 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 62.1 tp -109.92 122.36 47.36 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.156 1.382 . . . . 0.0 108.98 169.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.2 t -106.25 123.8 61.2 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 172.724 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.5 m -128.05 176.23 8.1 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 124.828 1.251 . . . . 0.0 111.092 171.614 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 52.7 m -110.12 151.5 27.16 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.605 1.562 . . . . 0.0 110.519 175.096 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -54.33 125.16 18.26 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.906 1.282 . . . . 0.0 112.201 178.549 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 97.3 -9.16 64.97 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 127.224 2.345 . . . . 0.0 114.301 -174.569 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -81.38 160.53 24.07 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 119.927 1.863 . . . . 0.0 112.547 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -91.88 111.34 22.84 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.473 1.109 . . . . 0.0 109.302 172.514 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -96.52 118.64 33.45 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.098 0.959 . . . . 0.0 111.143 -175.851 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 28.5 m -123.08 125.26 44.86 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.566 0.746 . . . . 0.0 112.13 -173.888 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -101.76 159.55 15.23 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.909 1.683 . . . . 0.0 110.755 169.554 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 21.0 m -110.67 128.91 55.89 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.179 1.392 . . . . 0.0 110.037 174.354 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 42.5 t -115.06 150.89 35.2 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.916 1.687 . . . . 0.0 111.67 171.407 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 62.0 p -148.28 143.86 27.23 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.254 -0.904 . . . . 0.0 111.362 169.503 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.438 ' CD2' ' HB3' ' A' ' 125' ' ' ALA . 3.3 m-85 . . . . . 0 N--CA 1.471 0.583 0 C-N-CA 126.251 1.82 . . . . 0.0 114.677 -176.665 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 55.0 p90 . . . . . 0 CA--C 1.539 0.527 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 75.9 t -96.12 133.72 36.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 C-N-CA 125.636 1.574 . . . . 0.0 107.302 168.597 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.451 HD22 ' CG ' ' A' ' 106' ' ' PHE . 5.5 tp -99.3 147.6 25.02 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.714 1.206 . . . . 0.0 110.123 174.143 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 23.0 m120 -136.21 154.3 50.97 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.745 1.618 . . . . 0.0 111.382 -176.923 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 12.6 t90 -129.84 137.9 50.7 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.425 1.09 . . . . 0.0 111.787 177.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -134.02 145.73 49.72 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 -174.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 56.7 ttt85 -101.92 142.03 33.85 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.26 1.424 . . . . 0.0 107.883 166.77 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 29.6 mtp -88.25 144.34 26.5 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 118.657 0.662 . . . . 0.0 112.54 175.183 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 74.3 m -106.45 149.47 38.35 Favored Pre-proline 0 CA--C 1.545 0.755 0 C-N-CA 125.43 1.492 . . . . 0.0 111.161 173.629 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -68.37 -15.86 42.73 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 124.016 3.144 . . . . 0.0 114.013 -173.28 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 18.4 m -76.94 8.96 3.24 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.813 1.245 . . . . 0.0 113.027 172.051 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 58.1 t30 70.53 45.75 0.59 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 127.693 2.397 . . . . 0.0 111.507 -177.555 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -128.93 -179.53 5.15 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.56 1.544 . . . . 0.0 110.368 -179.404 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.7 p -142.2 152.52 43.21 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 126.02 1.728 . . . . 0.0 110.503 -175.405 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -131.05 131.89 44.57 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.515 1.126 . . . . 0.0 111.177 174.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -77.69 121.23 23.72 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.473 1.109 . . . . 0.0 110.89 -178.125 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 48.0 mt -94.27 -45.01 7.69 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.476 1.51 . . . . 0.0 111.82 -173.031 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -168.35 175.64 6.29 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.497 1.919 . . . . 0.0 110.565 -171.059 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -158.41 165.8 33.78 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.435 1.494 . . . . 0.0 111.57 -175.319 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -153.06 117.11 2.82 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 124.233 1.013 . . . . 0.0 111.39 172.782 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo . . . . . 0 C--N 1.35 0.63 0 CA-C-N 119.665 0.916 . . . . 0.0 111.981 -12.463 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 35.2 mtp-105 . . . . . 0 N--CA 1.47 0.556 0 N-CA-C 113.187 0.81 . . . . 0.0 113.187 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 99.6 m-85 -97.52 116.25 29.37 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.856 1.263 . . . . 0.0 109.908 -178.756 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -130.37 141.25 50.57 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.714 1.205 . . . . 0.0 111.332 -172.462 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 47.5 t -126.53 125.93 68.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 C-N-CA 125.085 1.354 . . . . 0.0 109.706 178.537 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 87.3 m -130.54 131.29 44.98 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.925 1.29 . . . . 0.0 110.674 -176.327 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -79.66 140.76 36.94 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.923 0.889 . . . . 0.0 111.91 176.517 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 27.1 mt -95.1 157.1 37.05 Favored Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 125.586 1.554 . . . . 0.0 111.67 178.436 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -70.76 -2.76 11.41 Favored 'Trans proline' 0 CA--C 1.542 0.915 0 C-N-CA 123.619 2.88 . . . . 0.0 114.177 175.778 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -70.24 -8.95 54.17 Favored 'General case' 0 CA--C 1.555 1.141 0 N-CA-C 114.109 1.152 . . . . 0.0 114.109 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 108.03 -33.95 5.94 Favored Glycine 0 N--CA 1.476 1.336 0 C-N-CA 125.903 1.716 . . . . 0.0 116.443 168.567 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.49 73.28 0.9 Allowed 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.453 1.627 . . . . 0.0 110.224 169.599 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -157.45 142.37 16.79 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 125.171 1.389 . . . . 0.0 109.34 -167.323 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' PHE . . . . . 0.451 ' CG ' HD22 ' A' ' 65' ' ' LEU . 31.3 m-85 -149.45 135.17 18.65 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.056 0.542 . . . . 0.0 111.724 -169.089 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -90.99 136.25 33.2 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.022 0.929 . . . . 0.0 111.129 169.224 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 32.9 mtt -121.22 106.03 11.12 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 126.063 1.745 . . . . 0.0 109.38 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 33.8 t -110.98 128.88 55.98 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.257 1.023 . . . . 0.0 113.416 -169.346 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 28.2 t -96.88 100.85 11.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 C-N-CA 125.865 1.666 . . . . 0.0 106.61 168.051 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 89.0 t -73.96 129.23 36.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 124.09 0.956 . . . . 0.0 109.924 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 60.57 57.02 2.88 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.137 1.375 . . . . 0.0 110.967 173.577 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.78 156.31 39.46 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.338 1.055 . . . . 0.0 113.211 -171.68 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 23.6 mtm180 -133.66 160.68 36.81 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 126.533 1.933 . . . . 0.0 109.716 -168.341 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 32.2 mtp85 -55.65 -27.49 50.15 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 120.03 1.286 . . . . 0.0 113.258 171.614 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -69.89 -20.67 63.37 Favored 'General case' 0 CA--C 1.553 1.084 0 N-CA-C 114.476 1.287 . . . . 0.0 114.476 172.585 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -83.24 -9.81 58.92 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 121.061 -1.024 . . . . 0.0 112.879 175.025 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 71.2 m -59.88 135.6 57.75 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 120.211 -1.555 . . . . 0.0 111.634 173.816 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 160.27 -172.75 36.77 Favored Glycine 0 CA--C 1.53 1.028 0 C-N-CA 124.529 1.062 . . . . 0.0 113.365 -179.604 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.0 m -91.13 140.92 29.36 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.802 0.841 . . . . 0.0 109.985 176.27 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 52.9 m-85 -133.82 160.17 38.44 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.232 1.813 . . . . 0.0 110.632 178.639 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -155.99 149.54 24.85 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 124.299 1.04 . . . . 0.0 112.684 175.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 36.7 t -89.57 158.64 17.56 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.149 1.38 . . . . 0.0 111.054 173.532 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -149.32 170.43 29.59 Favored Glycine 0 N--CA 1.471 1.026 0 C-N-CA 125.634 1.587 . . . . 0.0 112.282 174.134 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' ALA . . . . . 0.438 ' HB3' ' CD2' ' A' ' 56' ' ' PHE . . . -156.68 159.21 38.17 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 173.608 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 21.0 tt -140.8 135.6 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 125.846 1.658 . . . . 0.0 109.934 174.253 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 19.9 m -69.31 160.79 30.59 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.515 0.726 . . . . 0.0 112.821 -179.76 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.53 -15.88 63.73 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 115.421 1.637 . . . . 0.0 115.421 -173.518 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -78.68 149.09 74.06 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 124.776 1.23 . . . . 0.0 112.445 -177.253 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -67.68 -22.48 43.73 Favored 'Trans proline' 0 CA--C 1.54 0.775 0 C-N-CA 123.125 2.55 . . . . 0.0 113.09 -179.638 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -79.19 -2.95 43.34 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 114.687 1.365 . . . . 0.0 114.687 176.199 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.46 167.71 16.07 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.769 1.228 . . . . 0.0 113.319 -178.283 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 22.3 pt20 -146.8 161.3 40.96 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.207 1.803 . . . . 0.0 109.312 173.671 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 20.9 mt -77.65 118.9 25.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 O-C-N 121.609 -0.682 . . . . 0.0 111.126 -174.665 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -89.76 128.14 36.07 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.313 1.445 . . . . 0.0 109.426 168.591 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -87.12 145.39 26.46 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.347 1.059 . . . . 0.0 110.861 178.64 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 5.8 t -94.36 -166.8 1.55 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.44 1.096 . . . . 0.0 112.237 172.001 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -68.02 153.01 44.64 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.33 1.452 . . . . 0.0 111.676 174.603 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 25.7 mtp-105 -91.15 146.51 23.77 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 125.346 1.458 . . . . 0.0 110.906 172.298 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -143.0 150.03 39.09 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.269 1.427 . . . . 0.0 111.837 178.653 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -93.0 132.49 37.04 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.599 1.16 . . . . 0.0 111.818 177.064 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 48.1 tp -103.63 126.33 50.71 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 166.151 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 33.6 ttm180 -128.38 109.94 11.89 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 124.342 1.057 . . . . 0.0 109.01 -178.476 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 21.8 t -102.32 119.53 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 123.872 0.869 . . . . 0.0 108.727 178.041 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 70.1 p -93.36 147.72 22.68 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 126.064 1.746 . . . . 0.0 109.887 178.12 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 10.6 pm0 -57.43 150.23 19.02 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.741 0.817 . . . . 0.0 112.592 -179.515 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 47.2 ttt85 . . . . . 0 C--O 1.236 0.358 0 C-N-CA 124.079 0.952 . . . . 0.0 110.918 -168.312 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.2 t . . . . . 0 N--CA 1.471 0.603 0 CA-C-O 121.25 0.548 . . . . 0.0 112.126 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -144.97 115.31 7.56 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 126.415 1.886 . . . . 0.0 108.493 175.109 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 93.3 p -140.88 159.31 62.72 Favored Pre-proline 0 CA--C 1.55 0.954 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 -168.741 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -69.84 161.6 86.1 Favored 'Cis proline' 0 C--N 1.354 0.867 0 CA-C-N 119.488 0.853 . . . . 0.0 111.6 -6.088 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.68 -24.49 67.8 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.148 0.795 . . . . 0.0 113.148 176.096 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 46.4 tp -141.0 121.26 13.89 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.639 1.576 . . . . 0.0 108.784 169.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 57.0 tp -107.17 125.45 51.11 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.241 1.417 . . . . 0.0 109.078 171.693 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.4 t -109.61 123.54 65.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.089 0.956 . . . . 0.0 108.702 173.611 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 26.8 m -127.42 164.38 28.53 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 124.707 1.203 . . . . 0.0 111.451 172.513 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 51.9 m -90.66 149.43 22.09 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.272 1.029 . . . . 0.0 110.451 171.656 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -56.98 123.66 15.93 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.117 0.967 . . . . 0.0 111.834 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 87.92 3.53 79.83 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 126.106 1.812 . . . . 0.0 114.569 -175.735 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -92.27 157.6 16.57 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.487 1.644 . . . . 0.0 111.569 170.685 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -82.45 130.37 35.09 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.187 0.995 . . . . 0.0 110.635 177.681 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -112.9 124.72 53.25 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.787 1.235 . . . . 0.0 111.099 -178.007 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 28.4 m -129.76 125.4 35.75 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 119.184 0.902 . . . . 0.0 112.078 -176.437 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -100.41 151.26 21.74 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.697 1.599 . . . . 0.0 110.621 169.564 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 58.0 m -99.54 130.39 45.78 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.292 1.437 . . . . 0.0 109.112 173.753 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 44.5 t -125.06 143.51 50.88 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 126.242 1.817 . . . . 0.0 111.496 177.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 96.3 p -153.97 156.82 38.16 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.103 -0.998 . . . . 0.0 113.131 168.661 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 . . . . . 0 CA--C 1.536 0.406 0 C-N-CA 126.846 2.058 . . . . 0.0 111.25 178.607 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 34.7 p90 . . . . . 0 CA--C 1.543 0.711 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 21.4 t -107.83 134.1 50.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 125.848 1.659 . . . . 0.0 109.027 169.75 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -104.53 141.08 37.02 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.648 1.179 . . . . 0.0 109.282 168.546 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -137.7 158.04 45.2 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.471 1.508 . . . . 0.0 111.182 -170.876 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 10.0 t90 -129.09 138.02 51.59 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.417 1.087 . . . . 0.0 112.187 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -131.19 141.41 50.05 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.247 1.419 . . . . 0.0 112.977 -175.752 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 48.7 ttp180 -101.11 143.98 30.56 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.936 2.094 . . . . 0.0 108.718 169.233 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 36.8 mtp -93.65 141.86 28.0 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.854 0.752 . . . . 0.0 112.398 178.86 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.0 m -92.21 158.49 39.06 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 124.849 1.26 . . . . 0.0 111.709 175.228 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_exo -55.81 -33.44 88.2 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 123.949 3.099 . . . . 0.0 114.192 177.398 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 12.6 m -77.03 8.28 4.03 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.201 1.4 . . . . 0.0 113.821 177.044 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 60.3 t30 70.19 22.84 5.38 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 127.279 2.232 . . . . 0.0 113.259 -178.281 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 45.4 mt-30 -90.14 -176.73 4.95 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.423 1.089 . . . . 0.0 110.364 169.857 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.6 p -138.3 152.18 48.28 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.515 1.526 . . . . 0.0 111.165 -175.316 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -132.58 129.33 38.86 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 126.505 1.922 . . . . 0.0 110.155 -176.551 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 44.9 tttm -85.76 121.5 28.51 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.194 0.998 . . . . 0.0 111.252 -171.396 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 53.5 mt -97.6 -48.69 5.15 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.914 1.285 . . . . 0.0 113.124 -168.769 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -170.66 172.68 5.71 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.88 1.672 . . . . 0.0 110.972 -172.629 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.59 165.49 32.7 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.993 1.317 . . . . 0.0 112.629 -177.47 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -140.63 121.0 8.86 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 125.684 1.594 . . . . 0.0 109.822 170.169 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo . . . . . 0 C--N 1.351 0.694 0 CA-C-N 120.065 1.059 . . . . 0.0 112.96 -9.404 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 44.0 mtp-105 . . . . . 0 N--CA 1.476 0.838 0 N-CA-C 111.995 0.368 . . . . 0.0 111.995 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -92.46 130.4 38.14 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.978 1.311 . . . . 0.0 108.56 173.412 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -131.06 152.15 50.67 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.083 1.353 . . . . 0.0 111.374 -177.249 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 97.4 t -126.61 123.21 62.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 125.534 1.533 . . . . 0.0 108.88 175.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 95.8 m -122.77 126.95 48.47 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.326 1.05 . . . . 0.0 110.787 -177.616 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 3.2 tp-100 -76.18 134.72 39.83 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.645 1.578 . . . . 0.0 109.989 171.931 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 33.3 mt -90.29 164.39 27.62 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 124.054 0.942 . . . . 0.0 112.004 176.145 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -55.37 -21.28 28.93 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 123.872 3.048 . . . . 0.0 114.172 172.058 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -60.19 -26.16 66.14 Favored 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 176.622 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 89.84 -17.25 53.99 Favored Glycine 0 CA--C 1.535 1.32 0 C-N-CA 125.355 1.455 . . . . 0.0 114.602 173.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 5.3 ptt180 -152.44 73.54 1.03 Allowed 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 123.024 1.393 . . . . 0.0 109.178 169.313 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -169.92 137.54 1.65 Allowed 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 128.322 2.649 . . . . 0.0 107.304 -179.081 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -141.58 145.44 35.07 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 114.46 1.282 . . . . 0.0 114.46 -166.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 -102.53 121.22 41.94 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.044 1.338 . . . . 0.0 110.506 168.731 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -101.29 103.85 14.84 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 126.467 1.907 . . . . 0.0 107.948 176.369 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 14.8 m -114.52 121.88 44.84 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 114.136 1.162 . . . . 0.0 114.136 -167.37 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 12.8 t -88.59 118.04 33.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 C-N-CA 125.084 1.354 . . . . 0.0 107.509 168.228 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 98.0 t -78.86 117.31 24.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 124.25 1.02 . . . . 0.0 109.21 173.461 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 55.6 mtp180 48.37 76.92 0.11 Allowed 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 126.787 2.035 . . . . 0.0 111.876 178.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -69.77 138.17 52.53 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.422 1.089 . . . . 0.0 111.891 -176.523 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.78 161.16 17.88 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 126.235 1.814 . . . . 0.0 110.195 178.342 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 76.9 mtm180 -56.76 -23.07 40.28 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 114.387 1.255 . . . . 0.0 114.387 -178.51 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -65.16 -23.6 67.15 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 170.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -82.13 -16.84 48.52 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.226 1.01 . . . . 0.0 113.365 -178.93 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 49.8 m -59.59 134.67 57.23 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 119.743 1.156 . . . . 0.0 112.693 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 152.68 -169.12 31.75 Favored Glycine 0 N--CA 1.472 1.086 0 C-N-CA 124.812 1.196 . . . . 0.0 113.249 -174.119 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.0 m -93.12 147.49 22.82 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.314 1.046 . . . . 0.0 111.146 -178.066 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -141.52 159.49 42.1 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.804 2.041 . . . . 0.0 111.5 -177.626 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.0 pp -154.34 154.1 32.77 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.618 1.567 . . . . 0.0 111.152 172.447 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 29.5 p -102.13 157.7 16.7 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.305 0.642 . . . . 0.0 112.566 171.313 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -149.06 145.16 13.17 Favored Glycine 0 N--CA 1.472 1.075 0 C-N-CA 124.997 1.284 . . . . 0.0 113.89 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -125.38 159.26 32.25 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.971 1.309 . . . . 0.0 113.04 -173.667 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 16.9 tt -159.5 137.57 2.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 125.332 1.453 . . . . 0.0 111.176 178.78 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 17.8 m -70.92 161.45 31.03 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.143 0.977 . . . . 0.0 112.664 175.059 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 17.8 mt -77.04 -12.56 59.95 Favored 'General case' 0 N--CA 1.479 0.994 0 O-C-N 120.69 -1.256 . . . . 0.0 114.335 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -65.82 143.83 98.65 Favored Pre-proline 0 CA--C 1.552 1.041 0 C-N-CA 124.046 0.939 . . . . 0.0 112.377 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_exo -55.58 -27.67 61.21 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 123.782 2.988 . . . . 0.0 114.695 176.442 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -83.24 -1.61 53.56 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.719 1.208 . . . . 0.0 114.218 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -67.94 162.77 23.59 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.366 1.066 . . . . 0.0 113.474 -177.57 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.27 153.21 38.4 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.812 1.645 . . . . 0.0 108.814 178.004 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 64.9 mt -76.53 124.75 35.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 123.631 0.773 . . . . 0.0 111.828 -173.528 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -97.11 145.46 25.98 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.695 1.198 . . . . 0.0 108.116 165.534 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -130.16 148.96 52.05 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.461 1.028 . . . . 0.0 111.818 -179.059 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 4.9 t -94.51 -166.11 1.42 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.011 1.325 . . . . 0.0 113.126 -173.054 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 82.8 mt -64.68 155.3 33.93 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.615 1.566 . . . . 0.0 111.734 175.542 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 31.0 mtp-105 -89.38 139.22 30.73 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.548 1.139 . . . . 0.0 110.444 173.043 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -137.11 151.01 48.37 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.413 1.485 . . . . 0.0 111.419 178.238 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -103.85 137.76 41.4 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.428 1.091 . . . . 0.0 111.754 -177.273 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 63.1 tp -106.14 128.97 54.27 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 125.747 1.619 . . . . 0.0 108.905 169.041 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 71.4 ttt180 -120.52 118.24 29.71 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.516 1.527 . . . . 0.0 109.399 171.268 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 32.8 t -102.17 119.44 50.48 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 C-N-CA 124.494 1.118 . . . . 0.0 108.432 170.21 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 63.0 p -99.66 144.77 28.36 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.526 1.531 . . . . 0.0 110.078 179.489 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -62.82 145.07 55.86 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.795 -0.566 . . . . 0.0 112.459 -174.431 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 46.9 ttt85 . . . . . 0 N--CA 1.468 0.427 0 C-N-CA 124.196 0.999 . . . . 0.0 110.857 -171.476 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.0 t . . . . . 0 N--CA 1.471 0.59 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.407 ' CD1' ' SG ' ' A' ' 123' ' ' CYS . 1.4 m-85 -127.39 141.95 51.55 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.143 0.977 . . . . 0.0 112.048 -168.202 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 95.9 p -141.08 159.39 61.89 Favored Pre-proline 0 CA--C 1.548 0.9 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 177.474 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -73.15 161.54 93.69 Favored 'Cis proline' 0 C--N 1.353 0.802 0 CA-C-N 118.925 0.652 . . . . 0.0 111.096 -11.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.5 -29.44 70.55 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 171.576 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 49.1 tp -140.53 121.93 15.01 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.82 1.648 . . . . 0.0 109.453 171.014 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 56.5 tp -104.81 126.68 52.13 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.74 1.616 . . . . 0.0 109.068 171.348 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 18.3 t -110.18 125.45 67.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 123.999 0.92 . . . . 0.0 108.533 171.58 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.1 m -129.47 165.14 30.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 124.671 1.188 . . . . 0.0 111.653 174.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 88.5 m -92.12 148.6 22.05 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.295 1.038 . . . . 0.0 109.849 171.353 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -56.23 123.8 15.78 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.987 0.915 . . . . 0.0 112.076 -177.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 93.58 -2.98 71.03 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 125.421 1.486 . . . . 0.0 114.74 -175.443 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -71.16 153.24 42.65 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.624 1.712 . . . . 0.0 111.461 169.893 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -84.28 106.53 15.97 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 169.063 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -94.25 123.18 37.49 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.863 0.865 . . . . 0.0 110.928 -172.047 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 42.0 m -131.63 126.83 35.69 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 119.051 0.841 . . . . 0.0 112.313 -170.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -98.29 156.74 16.57 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 126.139 1.776 . . . . 0.0 110.506 170.513 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.8 m -105.64 129.74 53.82 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.834 1.254 . . . . 0.0 109.18 171.431 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 67.8 m -115.84 124.4 50.59 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.58 1.152 . . . . 0.0 109.104 169.46 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 73.1 m -121.55 126.37 49.0 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 124.748 1.219 . . . . 0.0 110.075 -170.754 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 10.9 p90 . . . . . 0 CA--C 1.539 0.548 0 C-N-CA 124.961 1.304 . . . . 0.0 110.583 177.237 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 53.1 p90 . . . . . 0 CA--C 1.541 0.607 0 CA-C-O 121.284 0.564 . . . . 0.0 112.283 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 17.6 t -125.42 133.68 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 125.744 1.617 . . . . 0.0 107.786 168.314 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -105.89 136.17 46.02 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.138 1.375 . . . . 0.0 108.913 173.552 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -126.82 150.96 48.92 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.119 1.367 . . . . 0.0 111.502 178.355 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 14.0 t90 -127.59 138.93 53.01 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.242 1.417 . . . . 0.0 111.847 178.406 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -134.74 151.31 50.88 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.612 1.565 . . . . 0.0 113.815 -171.171 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -112.08 141.19 46.07 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.556 1.542 . . . . 0.0 109.328 168.433 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 84.5 mmm -73.79 137.73 44.06 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.473 0.709 . . . . 0.0 111.642 174.752 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 67.7 m -94.26 156.6 38.68 Favored Pre-proline 0 CA--C 1.548 0.882 0 C-N-CA 124.723 1.209 . . . . 0.0 111.57 170.668 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -55.65 -32.74 84.76 Favored 'Trans proline' 0 C--N 1.354 0.857 0 C-N-CA 124.038 3.159 . . . . 0.0 114.648 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.3 m -76.99 5.73 7.52 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.804 1.241 . . . . 0.0 113.835 178.113 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 72.93 21.01 3.38 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 127.843 2.457 . . . . 0.0 112.98 -175.791 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -90.41 -175.08 4.36 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.589 1.156 . . . . 0.0 110.314 170.031 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.9 p -139.02 145.26 39.42 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 125.618 1.567 . . . . 0.0 110.024 -175.582 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -121.27 131.48 54.24 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.165 0.986 . . . . 0.0 111.193 176.27 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -80.97 123.07 28.03 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.237 1.415 . . . . 0.0 110.773 -175.012 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 45.5 mt -100.94 -53.54 3.02 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.864 1.266 . . . . 0.0 112.2 -168.889 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -161.16 167.28 26.46 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.273 1.829 . . . . 0.0 110.014 -169.588 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.63 166.85 29.8 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.974 0.91 . . . . 0.0 112.292 -172.513 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 74.1 t80 -144.99 114.57 4.99 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 124.511 1.124 . . . . 0.0 110.558 170.467 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo . . . . . 0 C--N 1.351 0.671 0 CA-C-N 119.772 0.954 . . . . 0.0 112.567 -11.339 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 . . . . . 0 N--CA 1.475 0.784 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -95.8 140.94 29.86 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.427 1.091 . . . . 0.0 112.161 -168.925 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 58.9 ttt180 -144.54 147.27 33.01 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.11 1.364 . . . . 0.0 112.081 176.854 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 84.7 t -115.72 126.74 73.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 126.176 1.791 . . . . 0.0 108.763 170.265 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 98.5 m -130.51 132.29 45.55 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.361 1.464 . . . . 0.0 110.39 -177.276 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -77.68 138.47 39.09 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.09 0.556 . . . . 0.0 110.231 172.418 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 20.2 mt -76.85 156.44 82.55 Favored Pre-proline 0 CA--C 1.544 0.743 0 O-C-N 121.704 -0.622 . . . . 0.0 111.788 171.339 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -66.46 -6.4 15.03 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.504 2.802 . . . . 0.0 113.44 172.202 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -60.04 -26.09 65.85 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 124.086 0.955 . . . . 0.0 112.98 169.754 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 88.28 -10.58 70.69 Favored Glycine 0 CA--C 1.534 1.246 0 C-N-CA 125.079 1.323 . . . . 0.0 115.041 178.176 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 32.6 ptt180 -154.58 73.61 0.91 Allowed 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 118.76 1.28 . . . . 0.0 111.533 173.448 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -178.76 148.37 0.42 Allowed 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 128.157 2.583 . . . . 0.0 108.912 -177.388 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -138.01 146.6 43.27 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.793 0.837 . . . . 0.0 112.925 -177.099 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 6.6 m170 -109.2 131.26 55.24 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.033 1.733 . . . . 0.0 111.537 169.789 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -114.06 105.1 12.81 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 126.706 2.002 . . . . 0.0 107.762 -176.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 38.2 p -115.1 133.14 56.3 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 -168.131 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 15.4 t -96.25 104.71 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 126.772 2.029 . . . . 0.0 106.91 168.615 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 95.8 t -74.52 114.8 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 124.537 1.135 . . . . 0.0 108.742 177.861 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 10.1 mpt_? 55.34 84.96 0.07 Allowed 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 126.257 1.823 . . . . 0.0 111.317 -173.407 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -73.76 118.23 16.46 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.744 0.817 . . . . 0.0 111.213 178.472 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 9.4 mpt_? -85.82 159.86 19.61 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.41 1.484 . . . . 0.0 109.383 171.422 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 17.1 mmm180 -49.2 -39.17 28.53 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 120.937 -1.102 . . . . 0.0 113.011 172.516 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -67.36 -10.07 47.55 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 178.011 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -84.6 -8.45 58.89 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 120.107 1.321 . . . . 0.0 112.871 172.891 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.4 m -64.35 136.69 57.38 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 120.155 -1.59 . . . . 0.0 112.438 177.321 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 155.24 -166.74 32.72 Favored Glycine 0 N--CA 1.468 0.786 0 C-N-CA 124.101 0.858 . . . . 0.0 113.016 -178.462 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.0 m -97.26 140.42 31.77 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.525 1.13 . . . . 0.0 110.803 -176.926 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -135.73 163.0 31.17 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.3 1.84 . . . . 0.0 112.175 -177.717 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -162.13 146.62 12.46 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.568 1.547 . . . . 0.0 112.589 171.805 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' CYS . . . . . 0.407 ' SG ' ' CD1' ' A' ' 37' ' ' PHE . 1.8 p -108.54 170.69 7.86 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.038 1.735 . . . . 0.0 111.026 176.247 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -175.35 142.37 6.16 Favored Glycine 0 N--CA 1.471 1.026 0 O-C-N 121.237 -0.915 . . . . 0.0 114.184 177.865 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -109.73 148.2 31.84 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.567 1.147 . . . . 0.0 112.765 -176.74 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 21.3 tt -138.01 143.7 32.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 126.667 1.987 . . . . 0.0 110.078 177.125 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.7 m -67.5 161.56 25.2 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.871 0.868 . . . . 0.0 112.835 176.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -59.02 -25.74 63.94 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 115.223 1.564 . . . . 0.0 115.223 178.038 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -81.73 148.13 60.76 Favored Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 124.876 1.27 . . . . 0.0 112.52 -174.328 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -69.91 -24.97 28.4 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 123.261 2.64 . . . . 0.0 114.107 -171.776 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.3 -0.97 30.89 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.84 1.422 . . . . 0.0 114.84 178.517 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.79 173.95 5.71 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.512 1.525 . . . . 0.0 113.196 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 53.8 tp60 -134.99 143.84 47.05 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.114 1.766 . . . . 0.0 109.171 179.041 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 53.7 mt -72.45 114.84 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 170.419 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -85.13 112.74 20.96 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.396 1.079 . . . . 0.0 111.027 -178.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -90.67 158.88 16.68 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.033 1.733 . . . . 0.0 112.048 -177.126 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 4.9 t -145.98 -166.85 2.57 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.994 0.918 . . . . 0.0 111.799 169.397 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.88 136.55 57.03 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.727 1.211 . . . . 0.0 113.094 -172.685 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 80.0 mtt85 -72.43 146.33 47.03 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.709 0.804 . . . . 0.0 111.529 -177.917 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -120.78 135.58 55.12 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.064 1.745 . . . . 0.0 110.688 -176.187 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -104.42 139.28 39.59 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.341 1.056 . . . . 0.0 111.728 -175.644 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 52.5 tp -109.62 127.91 54.86 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.8 1.64 . . . . 0.0 109.659 171.132 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 60.7 ttt85 -118.25 119.29 34.21 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.678 1.591 . . . . 0.0 109.179 170.127 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 43.6 t -102.0 123.15 55.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 171.083 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 68.6 p -99.0 145.47 27.04 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.566 1.546 . . . . 0.0 109.208 175.713 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -66.43 141.81 57.8 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 121.54 -0.725 . . . . 0.0 111.754 -175.242 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 . . . . . 0 N--CA 1.468 0.444 0 C-N-CA 124.186 0.994 . . . . 0.0 110.598 -179.033 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 15.3 t . . . . . 0 N--CA 1.476 0.861 0 CA-C-O 120.973 0.416 . . . . 0.0 111.639 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.408 ' CE1' ' HB2' ' A' ' 123' ' ' CYS . 1.9 m-85 -125.0 136.61 53.89 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.405 1.482 . . . . 0.0 110.714 -169.926 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 88.7 p -140.96 157.24 67.72 Favored Pre-proline 0 CA--C 1.548 0.894 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 177.639 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -70.37 160.59 89.59 Favored 'Cis proline' 0 C--N 1.352 0.716 0 CA-C-N 119.0 0.679 . . . . 0.0 110.887 -11.532 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.46 -30.71 69.84 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 172.284 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 49.8 tp -140.32 120.68 14.0 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.569 1.548 . . . . 0.0 109.358 171.863 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 61.0 tp -102.83 127.02 50.17 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.45 1.5 . . . . 0.0 109.171 172.129 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.6 t -109.7 124.9 66.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 123.902 0.881 . . . . 0.0 108.811 171.703 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.2 m -127.17 169.91 17.88 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 124.639 1.176 . . . . 0.0 111.551 172.875 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 94.5 m -100.66 147.28 26.16 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.043 1.337 . . . . 0.0 110.058 173.101 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -59.27 126.6 28.33 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.178 0.991 . . . . 0.0 111.823 -174.678 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 91.65 -2.84 77.7 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 125.993 1.759 . . . . 0.0 114.473 -174.091 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 38.3 t0 -83.35 156.84 22.8 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.841 1.821 . . . . 0.0 112.004 173.267 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -79.21 123.75 27.7 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.567 0.747 . . . . 0.0 109.806 170.175 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -102.66 129.4 49.24 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 117.68 -1.152 . . . . 0.0 110.567 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 31.3 m -132.79 129.65 38.84 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 119.377 0.99 . . . . 0.0 112.222 -177.386 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -106.21 159.62 15.96 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 127.625 2.37 . . . . 0.0 110.731 169.823 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 85.9 m -109.76 134.72 51.7 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.5 1.52 . . . . 0.0 109.108 170.706 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 64.2 m -131.55 125.74 33.09 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.981 1.312 . . . . 0.0 110.237 172.98 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 91.2 p -104.29 148.17 26.67 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.099 0.96 . . . . 0.0 110.817 175.415 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 . . . . . 0 N--CA 1.466 0.325 0 C-N-CA 124.852 1.261 . . . . 0.0 112.347 178.056 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 35.0 p90 . . . . . 0 CA--C 1.543 0.688 0 CA-C-O 120.42 0.152 . . . . 0.0 111.318 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 50.6 t -95.87 124.34 48.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 N-CA-C 107.559 -1.274 . . . . 0.0 107.559 170.262 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.58 HD11 ' HE1' ' A' ' 108' ' ' MET . 2.2 tm? -99.33 141.76 31.68 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 126.655 1.982 . . . . 0.0 108.896 177.831 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -141.96 154.91 45.39 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.932 1.693 . . . . 0.0 111.258 -175.581 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 20.3 t90 -128.2 143.0 51.0 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.944 1.298 . . . . 0.0 111.395 175.34 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -138.13 148.3 44.79 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.818 1.247 . . . . 0.0 114.164 -170.356 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 53.5 ttt-85 -109.19 143.19 38.93 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.234 1.414 . . . . 0.0 109.65 168.765 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 85.7 mmm -75.38 135.07 40.82 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 118.333 0.515 . . . . 0.0 111.368 173.913 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.2 p -85.7 165.64 34.06 Favored Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 123.478 0.711 . . . . 0.0 112.429 172.883 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -58.62 -28.31 85.65 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 123.45 2.767 . . . . 0.0 113.498 170.726 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.7 m -83.52 0.96 44.24 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.874 1.27 . . . . 0.0 113.277 175.792 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 74.05 21.71 2.51 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 127.613 2.365 . . . . 0.0 113.429 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 18.7 mm100 -87.42 -178.96 6.28 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.71 0.804 . . . . 0.0 110.393 169.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.8 p -126.83 119.35 26.62 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.94 1.696 . . . . 0.0 109.388 -173.852 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -104.07 128.62 51.7 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.717 0.807 . . . . 0.0 111.199 -179.09 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -76.53 127.62 33.18 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.045 0.938 . . . . 0.0 112.065 -172.269 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 66.2 mt -106.75 -44.35 4.47 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 125.343 1.457 . . . . 0.0 112.406 -169.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -166.97 169.71 12.75 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.479 1.912 . . . . 0.0 110.432 -176.1 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.56 165.77 32.18 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.645 1.178 . . . . 0.0 112.76 -171.134 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 75.0 t80 -147.49 123.0 5.29 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 125.388 1.475 . . . . 0.0 110.533 170.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo . . . . . 0 C--N 1.351 0.665 0 CA-C-N 120.126 1.081 . . . . 0.0 111.94 -10.68 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 48.5 mtp180 . . . . . 0 N--CA 1.473 0.701 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -88.63 142.38 27.74 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.368 1.067 . . . . 0.0 111.388 176.617 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 48.6 mtm180 -143.0 154.16 43.71 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.054 1.341 . . . . 0.0 112.79 -172.018 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 37.6 t -126.49 134.05 67.25 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 126.392 1.877 . . . . 0.0 108.702 168.136 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 95.3 m -123.91 126.06 45.71 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.262 1.425 . . . . 0.0 108.666 169.325 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 6.8 pm0 -83.62 141.56 31.45 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.322 1.049 . . . . 0.0 111.146 174.85 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 18.1 mt -87.81 156.25 52.72 Favored Pre-proline 0 CA--C 1.542 0.668 0 C-N-CA 123.685 0.794 . . . . 0.0 111.526 178.698 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -66.43 -4.61 11.05 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 123.361 2.708 . . . . 0.0 114.148 176.163 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -71.83 -10.5 59.87 Favored 'General case' 0 CA--C 1.551 1.015 0 CA-C-N 119.895 1.225 . . . . 0.0 113.281 171.829 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 92.15 -19.43 49.58 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 125.775 1.655 . . . . 0.0 116.024 169.285 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 11.9 ptp180 -154.63 73.65 0.91 Allowed 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 122.736 1.255 . . . . 0.0 110.842 173.237 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -167.43 144.77 4.53 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 128.7 2.8 . . . . 0.0 107.834 -176.941 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -146.66 147.52 31.11 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 113.82 1.044 . . . . 0.0 113.82 -168.3 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 51.6 m170 -109.0 127.93 54.51 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.827 1.651 . . . . 0.0 109.758 168.196 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.58 ' HE1' HD11 ' A' ' 65' ' ' LEU . 1.1 mpt? -113.52 126.74 55.65 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 126.253 1.821 . . . . 0.0 108.592 -176.933 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 93.7 p -142.67 149.06 38.38 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 116.841 2.163 . . . . 0.0 116.841 -171.207 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 11.1 t -103.41 122.44 55.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 126.849 2.059 . . . . 0.0 108.684 174.278 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 86.3 t -73.59 120.98 23.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 124.382 1.073 . . . . 0.0 109.675 169.718 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 49.3 72.61 0.29 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 126.006 1.722 . . . . 0.0 111.807 172.353 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.58 135.4 52.85 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.367 1.067 . . . . 0.0 111.954 -172.692 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -102.88 157.8 16.72 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 126.312 1.845 . . . . 0.0 109.937 175.514 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 74.9 mtm180 -52.47 -30.39 29.59 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 175.388 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 32.1 t30 -63.14 -24.74 68.03 Favored 'General case' 0 CA--C 1.551 1.009 0 N-CA-C 114.927 1.455 . . . . 0.0 114.927 173.672 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -74.82 -21.19 59.42 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 119.811 1.187 . . . . 0.0 112.87 -179.11 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 17.6 m -57.65 131.86 51.53 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.552 1.141 . . . . 0.0 113.198 -175.905 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 156.64 -165.92 33.17 Favored Glycine 0 CA--C 1.529 0.961 0 C-N-CA 124.523 1.059 . . . . 0.0 113.157 -172.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.4 m -93.25 143.01 26.68 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.058 1.343 . . . . 0.0 111.139 -175.284 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 61.9 m-85 -140.81 157.3 45.59 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.702 1.601 . . . . 0.0 111.515 -177.852 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.6 pp -154.98 156.24 35.65 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.285 1.034 . . . . 0.0 111.857 173.437 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' CYS . . . . . 0.408 ' HB2' ' CE1' ' A' ' 37' ' ' PHE . 79.6 m -101.77 162.38 12.95 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.002 0.921 . . . . 0.0 110.741 173.539 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -155.11 158.83 28.65 Favored Glycine 0 N--CA 1.47 0.929 0 O-C-N 121.473 -0.767 . . . . 0.0 112.98 173.314 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -146.98 156.7 43.26 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 117.952 0.876 . . . . 0.0 112.766 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.0 tt -146.98 134.39 14.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 124.829 1.252 . . . . 0.0 110.983 -175.993 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 48.2 t -61.84 158.18 16.52 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.045 0.938 . . . . 0.0 113.068 178.666 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 68.4 mt -72.95 -12.61 61.01 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.26 1.024 . . . . 0.0 112.949 176.687 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -67.43 143.95 97.56 Favored Pre-proline 0 CA--C 1.554 1.1 0 C-N-CA 124.451 1.1 . . . . 0.0 112.583 177.755 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_exo -57.33 -30.77 88.94 Favored 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 123.624 2.883 . . . . 0.0 114.846 177.11 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -87.93 7.23 31.89 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 124.687 1.195 . . . . 0.0 114.163 -176.751 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.78 165.99 14.06 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.928 1.291 . . . . 0.0 114.319 -175.085 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 31.2 tt0 -146.49 149.88 34.5 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.215 1.806 . . . . 0.0 109.116 178.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 56.1 mt -73.39 124.64 30.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 123.377 0.671 . . . . 0.0 111.112 -176.002 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -84.81 142.99 29.38 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.037 1.735 . . . . 0.0 110.904 172.645 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -142.79 158.89 43.18 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.978 1.711 . . . . 0.0 110.638 -175.325 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 5.5 t -144.12 -171.57 3.59 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.424 1.09 . . . . 0.0 111.947 175.421 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -63.25 125.23 23.42 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.182 1.393 . . . . 0.0 110.585 -176.732 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -65.56 163.77 15.48 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 -173.15 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.96 168.21 10.27 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.021 2.129 . . . . 0.0 111.317 175.954 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -131.52 142.95 50.06 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.883 1.273 . . . . 0.0 111.623 177.602 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 66.1 tp -109.87 133.81 52.75 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 125.954 1.701 . . . . 0.0 109.883 170.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 72.0 ttt180 -123.94 120.14 31.64 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.676 1.59 . . . . 0.0 108.986 169.055 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 44.4 t -104.19 120.34 54.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 170.768 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 67.2 p -98.22 148.75 23.28 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.234 1.814 . . . . 0.0 109.521 177.452 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -64.02 151.01 44.07 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.313 -0.867 . . . . 0.0 113.226 -172.332 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 48.3 ttt85 . . . . . 0 C--O 1.236 0.359 0 C-N-CA 123.953 0.901 . . . . 0.0 108.638 -173.935 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 6.0 t . . . . . 0 N--CA 1.471 0.622 0 CA-C-O 120.502 0.192 . . . . 0.0 111.44 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.46 ' CD2' ' HB2' ' A' ' 123' ' ' CYS . 0.9 OUTLIER -160.28 157.86 28.82 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 125.943 1.697 . . . . 0.0 113.243 176.708 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 95.1 p -140.78 158.74 64.72 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 125.163 1.385 . . . . 0.0 112.568 174.954 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -73.48 160.88 95.18 Favored 'Cis proline' 0 C--N 1.351 0.686 0 CA-C-N 118.485 0.495 . . . . 0.0 111.311 -9.38 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.75 -30.58 71.59 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 171.511 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 45.9 tp -136.79 117.67 14.17 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.947 1.699 . . . . 0.0 109.046 171.895 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.2 tp -100.69 127.36 47.12 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.43 1.492 . . . . 0.0 109.439 174.029 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.0 t -109.99 124.2 66.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 123.979 0.911 . . . . 0.0 108.809 172.699 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.4 m -127.86 167.06 23.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 124.916 1.286 . . . . 0.0 111.595 172.999 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 67.1 m -93.4 148.49 22.02 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.485 1.114 . . . . 0.0 110.145 174.624 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -53.93 119.9 5.64 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.885 1.274 . . . . 0.0 111.708 177.359 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 94.59 -3.28 68.22 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 126.104 1.812 . . . . 0.0 114.886 -177.679 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -88.83 155.18 19.7 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 119.281 1.54 . . . . 0.0 111.582 174.544 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -80.82 134.61 35.81 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.292 -0.88 . . . . 0.0 111.437 173.198 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -107.22 131.75 53.83 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.13 1.772 . . . . 0.0 110.592 178.38 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 28.6 m -132.75 125.09 29.37 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.846 0.858 . . . . 0.0 111.302 -179.056 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -101.49 153.23 19.89 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.249 1.42 . . . . 0.0 110.357 169.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 66.9 m -117.05 117.67 30.27 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.213 1.005 . . . . 0.0 110.166 178.744 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 21.6 m -101.0 151.12 22.16 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.699 1.2 . . . . 0.0 113.157 169.652 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 70.3 m -127.05 115.42 19.17 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.01 1.324 . . . . 0.0 109.207 174.613 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 . . . . . 0 N--CA 1.468 0.471 0 C-N-CA 126.291 1.837 . . . . 0.0 110.083 -178.27 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 24.4 p90 . . . . . 0 CA--C 1.538 0.496 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 45.7 t -110.85 134.0 54.53 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 C-N-CA 127.076 2.15 . . . . 0.0 107.847 171.886 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 30.8 tp -109.17 134.14 52.11 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.324 0.65 . . . . 0.0 110.087 169.934 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -124.96 148.98 48.13 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.505 1.522 . . . . 0.0 111.241 -169.339 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 34.6 t-105 -110.22 138.83 46.07 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.4 1.48 . . . . 0.0 111.665 175.39 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -132.99 146.03 51.4 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.1 1.36 . . . . 0.0 112.441 -177.07 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 38.5 ttp180 -91.7 136.59 33.02 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.693 1.597 . . . . 0.0 107.541 167.271 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 16.6 ttm -111.44 133.14 53.95 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.972 1.309 . . . . 0.0 110.206 -179.168 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 51.0 m -85.62 160.61 53.07 Favored Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 125.301 1.44 . . . . 0.0 112.391 179.046 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_exo -58.56 -26.39 78.46 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 124.237 3.291 . . . . 0.0 114.136 174.36 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.9 p -76.95 1.32 18.06 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.891 1.677 . . . . 0.0 113.643 174.621 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 30.5 m-80 69.81 20.98 6.59 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 127.635 2.374 . . . . 0.0 112.786 -176.022 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -85.84 169.85 12.94 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.637 0.775 . . . . 0.0 110.364 169.768 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.7 p -138.92 152.48 47.77 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.967 1.307 . . . . 0.0 111.974 -173.597 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -136.9 131.11 32.66 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.362 1.865 . . . . 0.0 110.296 -178.786 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -85.05 129.27 34.83 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.16 0.984 . . . . 0.0 111.96 -173.592 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 55.5 mt -107.44 -57.1 2.13 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.282 1.033 . . . . 0.0 110.892 -172.89 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -162.18 173.84 13.73 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.526 1.13 . . . . 0.0 111.286 -173.216 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.62 172.17 18.28 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.104 1.361 . . . . 0.0 111.639 -177.9 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 45.6 t80 -138.46 118.36 9.79 Favored Pre-proline 0 CA--C 1.546 0.791 0 CA-C-O 118.507 -0.759 . . . . 0.0 110.521 168.264 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo . . . . . 0 C--N 1.353 0.768 0 CA-C-N 119.375 0.813 . . . . 0.0 111.153 -8.8 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.3 ptm180 . . . . . 0 N--CA 1.468 0.461 0 N-CA-C 116.72 2.119 . . . . 0.0 116.72 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -103.63 117.23 33.93 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.831 1.252 . . . . 0.0 109.751 176.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 15.8 mmt180 -144.43 155.51 43.78 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.697 0.799 . . . . 0.0 112.277 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 31.1 t -126.56 140.39 49.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 C-N-CA 125.085 1.354 . . . . 0.0 110.582 176.771 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 96.3 m -130.63 134.28 46.84 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 125.474 1.509 . . . . 0.0 111.098 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -78.79 135.33 37.06 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.997 1.319 . . . . 0.0 109.967 169.519 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 21.5 mt -82.11 159.29 65.63 Favored Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 124.187 0.995 . . . . 0.0 112.386 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -64.2 -6.89 12.39 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 123.301 2.667 . . . . 0.0 114.287 174.631 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -73.85 -7.65 53.03 Favored 'General case' 0 CA--C 1.551 1.017 0 CA-C-N 120.022 1.283 . . . . 0.0 113.261 170.009 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 83.49 -14.07 43.03 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 125.518 1.532 . . . . 0.0 116.092 169.428 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.57 73.52 0.91 Allowed 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 123.103 1.43 . . . . 0.0 111.341 172.085 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -171.47 145.41 2.08 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 128.482 2.713 . . . . 0.0 108.186 -176.356 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -142.96 141.68 31.48 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -168.823 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 23.0 m170 -102.57 130.34 49.4 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.598 1.559 . . . . 0.0 110.806 169.024 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -114.77 111.54 21.4 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.974 1.71 . . . . 0.0 108.621 179.351 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 32.4 m -110.37 130.46 55.55 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.623 1.169 . . . . 0.0 112.935 -168.611 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 34.0 t -110.47 101.41 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 126.889 2.076 . . . . 0.0 107.112 168.794 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 70.9 t -74.32 133.87 30.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 123.785 0.834 . . . . 0.0 110.266 -178.361 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 39.1 ttm180 57.2 62.84 2.06 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.911 1.284 . . . . 0.0 110.737 172.522 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.41 135.38 47.22 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 124.475 1.11 . . . . 0.0 111.173 -175.731 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.98 167.31 10.49 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.29 1.436 . . . . 0.0 111.026 175.336 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 12.2 mtp180 -58.86 -23.02 60.26 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 113.915 1.079 . . . . 0.0 113.915 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -69.34 -21.98 63.79 Favored 'General case' 0 CA--C 1.553 1.07 0 N-CA-C 114.104 1.15 . . . . 0.0 114.104 170.501 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -77.23 -20.12 55.68 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 119.771 1.169 . . . . 0.0 113.565 174.904 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 49.1 m -57.29 129.22 40.8 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 119.86 1.209 . . . . 0.0 112.358 -178.063 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 154.55 -166.71 32.35 Favored Glycine 0 N--CA 1.471 0.991 0 C-N-CA 124.218 0.913 . . . . 0.0 113.421 -171.561 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.3 m -91.01 143.64 26.5 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.436 1.094 . . . . 0.0 110.998 -175.678 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -140.73 158.06 44.52 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.637 1.975 . . . . 0.0 110.619 176.253 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.4 pp -158.03 166.48 32.43 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 120.839 -1.163 . . . . 0.0 113.466 -178.7 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' CYS . . . . . 0.46 ' HB2' ' CD2' ' A' ' 37' ' ' PHE . 0.1 OUTLIER -114.19 135.89 53.55 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.226 1.81 . . . . 0.0 110.697 -174.585 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -138.99 130.37 4.83 Favored Glycine 0 N--CA 1.472 1.072 0 C-N-CA 123.997 0.808 . . . . 0.0 113.276 179.186 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -102.72 155.07 18.56 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.75 1.22 . . . . 0.0 112.725 -176.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 19.2 tt -155.93 144.52 12.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 125.339 1.455 . . . . 0.0 109.57 176.135 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 2.2 m -65.27 161.58 19.15 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 121.045 -1.035 . . . . 0.0 112.971 178.505 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 59.2 tp -60.58 -34.66 74.52 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.112 0.965 . . . . 0.0 112.154 169.647 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -66.83 127.88 93.64 Favored Pre-proline 0 CA--C 1.554 1.133 0 C-N-CA 124.481 1.112 . . . . 0.0 111.891 178.295 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -56.69 -24.59 55.59 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 124.108 3.205 . . . . 0.0 115.834 -178.744 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -70.6 -6.45 36.75 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 178.799 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.06 173.23 5.69 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.458 1.503 . . . . 0.0 114.103 -178.594 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -140.5 161.77 36.93 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.215 1.806 . . . . 0.0 109.668 174.481 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 28.4 mt -82.7 124.36 39.31 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 CA-C-O 121.174 0.511 . . . . 0.0 111.44 -169.787 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -91.41 127.31 36.8 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.342 1.857 . . . . 0.0 110.178 171.86 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -137.25 139.1 40.76 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.101 1.36 . . . . 0.0 111.041 -178.074 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 57.5 m -147.74 143.51 27.62 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.812 1.645 . . . . 0.0 110.063 171.303 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 42.6 mt 66.84 -178.55 0.21 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 126.978 2.111 . . . . 0.0 113.526 176.176 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.4 145.73 20.63 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.243 1.817 . . . . 0.0 110.572 169.656 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.86 165.09 13.48 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.829 1.652 . . . . 0.0 110.897 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -127.35 136.09 51.41 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 124.392 1.077 . . . . 0.0 110.23 -171.3 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 62.5 tp -110.36 131.89 54.66 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 125.554 1.541 . . . . 0.0 109.598 174.117 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 70.8 ttt180 -122.86 120.97 35.06 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.717 1.607 . . . . 0.0 109.566 170.743 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 28.7 t -104.41 118.22 51.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 C-N-CA 124.429 1.092 . . . . 0.0 109.026 170.155 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 71.9 p -98.5 155.71 17.13 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.738 1.615 . . . . 0.0 110.935 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -64.45 141.24 58.84 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 121.61 0.719 . . . . 0.0 112.347 -177.219 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 26.0 ttp-105 . . . . . 0 N--CA 1.466 0.362 0 C-N-CA 125.133 1.373 . . . . 0.0 110.166 179.279 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 91.8 m . . . . . 0 N--CA 1.47 0.564 0 CA-C-O 121.152 0.501 . . . . 0.0 110.463 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 50.6 t80 -145.47 118.88 9.0 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.225 1.81 . . . . 0.0 109.27 175.597 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 71.7 m -140.77 159.97 60.48 Favored Pre-proline 0 N--CA 1.477 0.886 0 C-N-CA 124.306 1.042 . . . . 0.0 113.352 -168.804 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -70.03 156.69 93.39 Favored 'Cis proline' 0 C--N 1.354 0.832 0 CA-C-N 119.723 0.937 . . . . 0.0 111.415 -4.749 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.03 -21.92 64.06 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 176.705 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 51.5 tp -143.68 121.68 12.09 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.311 1.444 . . . . 0.0 108.876 169.954 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 49.7 tp -111.12 126.96 55.39 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.536 1.534 . . . . 0.0 109.264 173.233 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 40.3 t -115.78 120.08 63.74 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 124.219 1.008 . . . . 0.0 108.927 176.74 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 26.9 m -123.64 166.97 18.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 125.57 1.548 . . . . 0.0 111.72 174.449 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 24.4 m -90.95 151.11 21.21 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.796 1.238 . . . . 0.0 110.701 174.227 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -51.73 124.87 13.42 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.246 1.418 . . . . 0.0 111.56 174.069 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.57 -1.36 88.9 Favored Glycine 0 CA--C 1.533 1.213 0 C-N-CA 125.487 1.517 . . . . 0.0 114.849 -177.856 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -88.67 162.13 16.47 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 119.421 1.61 . . . . 0.0 111.808 175.28 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -89.89 136.44 33.04 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.192 0.997 . . . . 0.0 110.65 176.264 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -116.79 135.95 53.35 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.255 1.422 . . . . 0.0 110.95 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 22.4 m -132.72 124.26 27.83 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 118.945 0.793 . . . . 0.0 111.869 178.729 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -100.79 159.56 15.09 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.648 1.579 . . . . 0.0 110.239 169.009 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 35.9 m -116.22 131.36 56.96 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.154 1.381 . . . . 0.0 110.38 177.51 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 50.3 t -117.96 143.26 46.52 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.457 1.903 . . . . 0.0 112.533 176.42 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 68.7 m -142.82 131.12 22.11 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.602 1.161 . . . . 0.0 111.417 177.158 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 . . . . . 0 N--CA 1.474 0.75 0 C-N-CA 126.641 1.977 . . . . 0.0 113.126 177.588 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 51.0 p90 . . . . . 0 CA--C 1.539 0.522 0 CA-C-O 120.606 0.241 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 46.0 t -107.87 136.07 44.46 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 124.887 1.275 . . . . 0.0 108.715 174.202 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -123.25 123.6 41.13 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.313 1.445 . . . . 0.0 108.776 -177.204 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 9.9 m-80 -123.48 152.51 41.63 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.559 1.543 . . . . 0.0 113.153 -167.474 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 12.6 t90 -117.51 135.71 53.74 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.836 1.654 . . . . 0.0 111.645 175.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -130.69 147.98 52.42 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.239 1.416 . . . . 0.0 113.481 -178.333 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 40.3 ttp180 -100.29 137.26 38.96 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 126.543 1.937 . . . . 0.0 107.331 167.238 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 16.0 ttm -112.02 134.84 53.33 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.321 1.448 . . . . 0.0 110.423 -175.362 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.1 m -91.4 157.5 42.24 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 124.82 1.248 . . . . 0.0 112.143 178.29 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -56.46 -31.48 85.99 Favored 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 124.209 3.273 . . . . 0.0 114.009 176.563 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.4 m -76.93 9.77 2.71 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.209 1.404 . . . . 0.0 113.624 177.852 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 64.2 t30 69.69 26.29 4.97 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 127.104 2.162 . . . . 0.0 112.908 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -94.45 168.36 10.92 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.245 1.018 . . . . 0.0 110.479 172.076 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.0 p -138.81 152.49 47.92 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.069 1.348 . . . . 0.0 111.536 -178.637 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -133.62 129.93 37.6 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 126.584 1.954 . . . . 0.0 110.105 -178.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -82.95 129.05 34.98 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.863 0.865 . . . . 0.0 111.389 -175.325 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 55.3 mt -104.21 -50.02 3.45 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.173 0.989 . . . . 0.0 111.963 -171.121 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -170.25 169.52 7.69 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.611 1.964 . . . . 0.0 109.675 -175.25 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.59 153.27 22.81 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.872 1.269 . . . . 0.0 110.926 -176.074 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -105.48 135.61 19.34 Favored Pre-proline 0 CA--C 1.547 0.846 0 C-N-CA 123.972 0.909 . . . . 0.0 110.994 174.676 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo . . . . . 0 C--N 1.352 0.727 0 CA-C-N 119.395 0.819 . . . . 0.0 111.102 -6.386 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.4 ptp180 . . . . . 0 N--CA 1.477 0.885 0 N-CA-C 114.71 1.374 . . . . 0.0 114.71 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -103.18 147.98 26.34 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.209 1.404 . . . . 0.0 111.968 -172.681 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -143.24 151.98 41.19 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.852 1.661 . . . . 0.0 111.989 172.396 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 46.2 t -121.32 128.56 75.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 124.414 1.085 . . . . 0.0 110.139 169.858 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 91.5 m -122.96 132.4 54.14 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.137 1.375 . . . . 0.0 110.312 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 24.8 tt0 -86.78 139.08 31.06 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.978 0.911 . . . . 0.0 110.722 173.26 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 28.7 mt -92.46 158.29 38.86 Favored Pre-proline 0 CA--C 1.546 0.794 0 C-N-CA 124.897 1.279 . . . . 0.0 111.808 177.55 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -67.72 -1.81 7.42 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 123.648 2.899 . . . . 0.0 114.235 175.754 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 25.3 m120 -64.81 -16.78 63.54 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 172.848 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 105.44 -34.0 6.11 Favored Glycine 0 N--CA 1.474 1.216 0 C-N-CA 126.127 1.822 . . . . 0.0 114.293 170.009 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 35.0 ptt180 -154.58 73.59 0.91 Allowed 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 123.098 1.428 . . . . 0.0 110.813 169.38 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -151.83 137.69 18.05 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 127.761 2.425 . . . . 0.0 106.958 179.32 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 -139.81 139.52 36.39 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -167.626 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -103.55 130.68 51.0 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.836 1.254 . . . . 0.0 111.71 170.51 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -107.04 105.4 15.4 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 127.276 2.23 . . . . 0.0 108.966 179.327 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 30.2 t -107.6 123.92 49.19 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.727 0.811 . . . . 0.0 112.705 -170.23 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 12.1 t -95.25 119.86 43.88 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 126.355 1.862 . . . . 0.0 106.928 169.024 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 81.3 t -91.43 128.54 43.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 123.558 0.743 . . . . 0.0 109.876 175.406 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 69.9 ttt180 53.46 60.55 3.63 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.911 1.684 . . . . 0.0 111.604 174.22 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.06 134.67 52.32 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.735 0.814 . . . . 0.0 111.362 -172.526 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.22 167.28 10.68 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.615 1.566 . . . . 0.0 110.261 -179.439 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 88.4 mtm-85 -56.88 -27.75 60.94 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 120.96 -1.088 . . . . 0.0 113.205 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -56.43 -27.77 57.58 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 126.673 1.989 . . . . 0.0 114.527 169.744 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 -86.95 -14.47 41.7 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 -175.048 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 52.7 m -59.36 129.88 44.19 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.793 1.179 . . . . 0.0 112.066 175.577 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 164.46 -159.7 32.67 Favored Glycine 0 N--CA 1.472 1.09 0 O-C-N 121.792 -0.567 . . . . 0.0 113.727 -176.2 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 8.5 m -100.65 144.42 29.65 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.107 1.363 . . . . 0.0 109.983 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 -143.62 155.43 44.26 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.653 1.581 . . . . 0.0 111.551 -178.941 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.3 pp -157.12 164.91 37.35 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.891 1.276 . . . . 0.0 112.525 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 21.2 t -113.78 155.51 25.52 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.282 1.433 . . . . 0.0 111.052 -179.382 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -154.67 144.23 10.89 Favored Glycine 0 N--CA 1.471 0.995 0 O-C-N 121.304 -0.873 . . . . 0.0 114.297 177.076 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -132.2 158.2 42.35 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -173.562 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 17.0 tt -152.34 134.97 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 125.316 1.446 . . . . 0.0 111.17 178.37 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 60.9 m -72.9 161.64 30.46 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.108 1.363 . . . . 0.0 113.417 177.324 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -59.73 -21.56 60.85 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 116.122 1.897 . . . . 0.0 116.122 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -72.92 147.73 88.84 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 124.399 1.08 . . . . 0.0 112.653 -173.209 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -67.22 -20.2 49.67 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.085 2.523 . . . . 0.0 112.75 176.469 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 82.7 tttt -75.82 -13.07 60.28 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 124.801 1.241 . . . . 0.0 113.558 174.831 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.11 161.64 26.45 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.533 1.133 . . . . 0.0 113.033 -177.822 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -147.98 152.76 38.04 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.914 1.686 . . . . 0.0 108.631 175.148 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 36.2 mt -71.69 115.39 11.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 O-C-N 121.695 -0.628 . . . . 0.0 110.63 -176.187 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 48.1 tttp -90.63 141.8 28.41 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.829 1.252 . . . . 0.0 109.661 169.571 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -110.87 151.01 28.35 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.69 1.196 . . . . 0.0 111.96 -175.837 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 59.8 p -86.4 176.95 7.6 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.815 1.246 . . . . 0.0 113.275 174.305 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 99.1 mt -68.65 139.95 55.47 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 166.585 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.63 148.97 33.02 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 -178.33 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -123.76 169.64 11.32 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 127.182 2.193 . . . . 0.0 111.243 177.266 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -119.74 141.7 49.2 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.981 1.312 . . . . 0.0 112.37 179.644 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 52.2 tp -109.69 137.8 46.98 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 125.817 1.647 . . . . 0.0 109.752 169.49 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -128.84 125.01 36.81 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.604 1.562 . . . . 0.0 110.31 173.078 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 40.6 t -108.13 112.44 40.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 C-N-CA 125.224 1.409 . . . . 0.0 108.597 169.314 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 64.6 p -91.59 154.93 18.72 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.573 1.549 . . . . 0.0 110.241 177.698 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -58.88 151.0 22.63 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.754 0.822 . . . . 0.0 112.693 -175.928 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 22.9 tpt180 . . . . . 0 N--CA 1.466 0.361 0 C-N-CA 124.895 1.278 . . . . 0.0 109.893 -176.549 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.0 t . . . . . 0 N--CA 1.471 0.585 0 CA-C-O 121.446 0.641 . . . . 0.0 111.568 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -134.34 125.66 28.08 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.964 1.706 . . . . 0.0 109.704 -173.073 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 91.0 p -140.87 157.49 67.34 Favored Pre-proline 0 CA--C 1.549 0.909 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 -169.435 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -68.32 162.17 80.04 Favored 'Cis proline' 0 C--N 1.355 0.92 0 CA-C-N 119.474 0.848 . . . . 0.0 111.862 -4.453 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.82 -26.52 68.17 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 176.639 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 48.0 tp -141.81 123.28 14.95 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.493 1.517 . . . . 0.0 108.889 170.319 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 53.7 tp -108.79 125.1 51.58 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.3 1.44 . . . . 0.0 109.34 172.326 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.2 t -110.4 121.39 63.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 124.165 0.986 . . . . 0.0 108.967 175.83 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.5 m -125.46 172.15 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 C-N-CA 125.009 1.323 . . . . 0.0 111.972 173.496 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 9.5 m -96.94 151.86 19.28 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 125.789 1.636 . . . . 0.0 110.612 176.237 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -45.71 122.81 3.9 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.536 1.134 . . . . 0.0 112.525 169.343 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.57 3.21 88.53 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 125.502 1.525 . . . . 0.0 114.508 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 31.2 t0 -90.4 159.12 16.75 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 119.393 1.597 . . . . 0.0 112.375 177.319 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 70.2 m-20 -88.96 117.57 28.07 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.345 1.058 . . . . 0.0 110.369 176.506 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -99.19 130.07 45.47 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.856 1.262 . . . . 0.0 110.547 178.22 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 60.9 m -131.92 127.2 35.93 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 119.347 0.976 . . . . 0.0 111.41 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -101.3 158.44 16.05 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.135 1.774 . . . . 0.0 110.474 172.573 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 37.5 m -106.69 131.23 54.06 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.322 1.449 . . . . 0.0 109.28 173.67 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 48.5 t -111.69 129.74 56.01 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.902 1.281 . . . . 0.0 110.893 169.302 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 8.4 t -122.46 131.22 53.76 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.537 1.135 . . . . 0.0 108.666 173.078 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 41.3 p90 . . . . . 0 N--CA 1.47 0.559 0 C-N-CA 124.442 1.097 . . . . 0.0 112.291 -176.188 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 28.5 p90 . . . . . 0 CA--C 1.537 0.472 0 N-CA-C 114.718 1.377 . . . . 0.0 114.718 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 64.5 t -105.88 129.48 58.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 126.529 1.932 . . . . 0.0 107.017 167.581 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 51.3 tp -99.32 143.21 29.84 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.94 1.296 . . . . 0.0 109.453 173.94 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -138.62 154.56 48.67 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.507 1.523 . . . . 0.0 111.032 -176.706 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 14.9 t90 -128.74 135.66 49.51 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.019 1.328 . . . . 0.0 110.744 175.254 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 57.8 m-85 -129.06 148.9 51.05 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.95 1.3 . . . . 0.0 113.596 -174.001 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 55.3 ttt-85 -109.03 142.99 38.92 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.694 1.598 . . . . 0.0 108.257 167.466 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 30.1 mtp -85.77 145.88 27.04 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 118.948 0.794 . . . . 0.0 112.509 176.484 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 69.1 m -94.07 157.66 37.42 Favored Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 125.494 1.518 . . . . 0.0 111.37 173.618 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -66.71 -16.72 51.2 Favored 'Trans proline' 0 CA--C 1.54 0.825 0 C-N-CA 123.256 2.637 . . . . 0.0 113.383 176.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 40.7 p -76.98 -1.15 27.26 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.118 1.767 . . . . 0.0 113.783 169.826 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 70.15 20.98 6.15 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 127.849 2.46 . . . . 0.0 113.08 -172.653 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -88.53 -172.68 3.85 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.423 1.089 . . . . 0.0 110.175 168.672 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.0 p -142.76 151.49 41.29 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.83 1.652 . . . . 0.0 110.728 -176.73 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -128.96 133.41 47.8 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 124.645 1.178 . . . . 0.0 111.616 174.878 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -78.15 129.22 34.9 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.43 1.092 . . . . 0.0 111.472 -179.158 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 57.9 mt -105.57 -47.75 3.84 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 125.575 1.55 . . . . 0.0 112.345 -169.645 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -162.04 170.02 19.99 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 127.072 2.149 . . . . 0.0 109.68 -174.292 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.55 171.52 19.5 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.41 1.084 . . . . 0.0 112.042 -172.291 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -146.79 111.45 4.17 Favored Pre-proline 0 CA--C 1.546 0.799 0 C-N-CA 125.026 1.33 . . . . 0.0 109.462 171.349 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo . . . . . 0 CA--C 1.54 0.794 0 CA-C-N 119.641 0.908 . . . . 0.0 111.721 -5.468 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 82.0 mtt85 . . . . . 0 N--CA 1.471 0.6 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -91.34 131.56 36.76 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 -164.554 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 21.4 ttm-85 -144.49 143.99 31.13 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.497 1.119 . . . . 0.0 112.352 169.222 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 91.8 t -107.3 131.31 57.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 126.638 1.975 . . . . 0.0 109.035 173.75 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 90.0 m -130.58 133.27 46.05 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.32 1.448 . . . . 0.0 110.686 -178.877 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -79.08 141.79 37.04 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.165 0.986 . . . . 0.0 112.318 178.095 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 26.6 mt -92.88 162.4 28.95 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 123.543 0.737 . . . . 0.0 111.628 171.637 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -58.04 -21.03 48.32 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 123.924 3.083 . . . . 0.0 114.093 172.574 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 10.9 t-20 -64.99 -13.83 58.77 Favored 'General case' 0 CA--C 1.552 1.02 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 -179.325 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 83.08 -34.01 2.86 Favored Glycine 0 N--CA 1.475 1.281 0 C-N-CA 125.882 1.706 . . . . 0.0 114.649 171.482 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 23.0 ptt180 -130.17 73.5 1.54 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 125.391 1.476 . . . . 0.0 109.523 169.36 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -178.78 140.68 0.18 Allowed 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 127.569 2.348 . . . . 0.0 109.338 -177.364 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -147.3 153.64 39.97 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.316 1.046 . . . . 0.0 112.79 -168.237 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -106.91 139.51 41.21 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.609 1.564 . . . . 0.0 111.464 169.167 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.4 mpt? -120.1 106.11 11.66 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 126.471 1.908 . . . . 0.0 109.05 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 77.8 p -108.75 128.26 54.72 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.872 0.869 . . . . 0.0 113.333 -172.042 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 32.5 t -100.14 99.07 7.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 127.859 2.463 . . . . 0.0 106.846 169.107 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 29.2 m -74.46 139.77 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 O-C-N 121.749 -0.595 . . . . 0.0 111.861 178.456 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 32.2 ttm180 53.84 49.51 18.96 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.81 1.644 . . . . 0.0 112.626 170.265 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.5 148.56 50.4 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.195 0.998 . . . . 0.0 112.778 -171.007 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -124.32 164.73 19.0 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.836 1.254 . . . . 0.0 111.856 178.83 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 86.5 mtm-85 -52.58 -37.21 57.58 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.401 1.081 . . . . 0.0 113.557 -172.326 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -48.43 -34.31 10.77 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.859 2.064 . . . . 0.0 114.599 171.289 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -81.51 -13.91 57.57 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.504 1.122 . . . . 0.0 112.738 -168.765 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.8 m -59.92 131.1 49.82 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.307 1.043 . . . . 0.0 112.474 179.127 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 161.46 -166.83 36.08 Favored Glycine 0 N--CA 1.473 1.134 0 C-N-CA 124.418 1.008 . . . . 0.0 113.622 -171.749 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 7.6 m -96.62 140.0 31.88 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.28 1.032 . . . . 0.0 110.816 -175.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 64.8 m-85 -136.44 156.73 48.21 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.004 1.722 . . . . 0.0 111.704 179.425 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -156.59 150.89 25.34 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 176.681 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 52.1 t -95.04 151.62 19.03 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 126.486 1.914 . . . . 0.0 111.437 177.648 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -164.1 138.07 5.09 Favored Glycine 0 N--CA 1.472 1.069 0 O-C-N 121.424 -0.797 . . . . 0.0 114.538 172.755 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -121.27 159.2 26.48 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.474 1.11 . . . . 0.0 112.644 -178.96 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 21.2 tt -147.57 135.9 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 125.586 1.554 . . . . 0.0 111.249 -176.223 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 36.8 t -72.25 161.17 31.23 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.044 0.937 . . . . 0.0 113.46 -178.99 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 65.7 mt -82.83 -11.45 58.23 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.735 1.214 . . . . 0.0 112.693 169.25 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -68.73 157.23 89.17 Favored Pre-proline 0 CA--C 1.551 1.018 0 C-N-CA 125.067 1.347 . . . . 0.0 112.358 176.193 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -66.97 -21.82 49.18 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 122.968 2.445 . . . . 0.0 113.192 178.2 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.52 6.28 15.3 Favored 'General case' 0 CA--C 1.551 0.994 0 N-CA-C 114.817 1.414 . . . . 0.0 114.817 177.149 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -62.62 159.22 16.44 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.755 1.391 . . . . 0.0 114.755 -171.849 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -157.23 149.13 22.5 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 127.091 2.156 . . . . 0.0 108.29 -176.478 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 11.7 mm -71.44 107.6 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 171.302 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -82.31 88.42 6.54 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.954 0.902 . . . . 0.0 109.308 173.249 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -69.97 134.68 48.61 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.116 0.966 . . . . 0.0 111.37 -178.237 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 68.7 m -84.74 155.95 21.65 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.155 0.982 . . . . 0.0 112.338 171.457 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -59.82 128.26 36.02 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 121.694 -0.629 . . . . 0.0 109.426 169.887 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -69.67 157.99 36.21 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 114.371 1.249 . . . . 0.0 114.371 -170.969 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -127.77 164.41 22.21 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.791 2.037 . . . . 0.0 111.639 176.889 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -116.24 140.35 49.41 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.767 1.227 . . . . 0.0 111.542 177.354 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 62.1 tp -106.97 134.63 49.83 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.983 1.713 . . . . 0.0 109.563 169.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 59.7 ttt85 -126.92 122.67 35.25 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 125.652 1.581 . . . . 0.0 109.786 170.558 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 36.4 t -107.46 115.99 49.99 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 C-N-CA 124.866 1.266 . . . . 0.0 108.626 171.283 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 23.6 p -87.92 161.72 17.3 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.858 1.263 . . . . 0.0 110.925 -179.506 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -58.13 153.01 15.65 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 122.879 0.471 . . . . 0.0 110.376 168.295 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 17.2 mtt180 . . . . . 0 N--CA 1.467 0.386 0 C-N-CA 123.448 0.699 . . . . 0.0 110.011 176.688 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 15.2 t . . . . . 0 N--CA 1.47 0.555 0 N-CA-C 110.197 -0.298 . . . . 0.0 110.197 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -148.38 121.78 9.06 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.019 1.328 . . . . 0.0 111.075 -169.528 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 89.8 p -140.94 160.23 59.1 Favored Pre-proline 0 CA--C 1.55 0.981 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -172.352 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -68.49 162.55 79.94 Favored 'Cis proline' 0 C--N 1.354 0.825 0 CA-C-N 119.883 0.994 . . . . 0.0 111.482 -7.849 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.6 -30.74 71.57 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 174.325 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 33.1 tp -135.46 123.37 22.63 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.739 1.615 . . . . 0.0 109.061 171.929 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 57.6 tp -107.49 126.6 52.72 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.587 1.155 . . . . 0.0 109.358 169.929 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.4 t -110.2 124.32 66.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 124.011 0.924 . . . . 0.0 108.916 173.676 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.6 m -128.24 167.29 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 124.904 1.282 . . . . 0.0 111.938 173.629 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 51.4 m -93.62 148.92 21.66 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.571 1.148 . . . . 0.0 110.466 175.274 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -53.97 119.33 4.89 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.414 1.486 . . . . 0.0 112.103 178.227 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.04 -0.43 78.9 Favored Glycine 0 CA--C 1.532 1.124 0 C-N-CA 126.21 1.862 . . . . 0.0 115.057 -178.068 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 40.6 t0 -86.15 158.73 19.7 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 119.11 1.455 . . . . 0.0 111.223 171.912 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 12.1 p30 -80.85 150.84 28.96 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-O 121.911 0.862 . . . . 0.0 111.453 169.76 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -133.38 122.59 23.99 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.125 1.77 . . . . 0.0 110.576 -173.443 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 28.0 m -129.38 126.86 39.82 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 118.832 0.742 . . . . 0.0 111.854 -176.57 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -101.95 157.07 17.13 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.212 1.805 . . . . 0.0 109.817 169.466 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 31.6 m -106.35 123.78 48.58 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.944 1.298 . . . . 0.0 109.553 175.509 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 44.8 t -107.08 134.76 49.73 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.657 1.183 . . . . 0.0 109.735 168.862 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 9.2 m -133.72 128.82 35.72 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.7 0.8 . . . . 0.0 110.222 -174.788 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.1 p90 . . . . . 0 CA--C 1.537 0.476 0 C-N-CA 124.373 1.069 . . . . 0.0 111.595 173.767 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 32.9 p90 . . . . . 0 CA--C 1.538 0.507 0 N-CA-C 115.154 1.538 . . . . 0.0 115.154 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 58.2 t -124.33 135.29 64.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 127.49 2.316 . . . . 0.0 106.981 167.689 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 29.3 tp -99.39 138.7 36.11 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.509 0.724 . . . . 0.0 109.924 172.514 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.507 HD21 HG22 ' A' ' 126' ' ' ILE . 7.2 m-80 -130.93 159.19 38.17 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.818 1.247 . . . . 0.0 111.483 -172.956 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 9.0 t90 -125.84 138.21 53.8 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.312 1.045 . . . . 0.0 111.979 177.205 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -131.15 144.7 51.57 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.777 1.231 . . . . 0.0 112.796 -176.478 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -106.78 142.61 36.14 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.45 1.5 . . . . 0.0 108.54 168.428 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 26.1 mtp -83.29 143.91 30.07 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.95 0.795 . . . . 0.0 112.461 175.94 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 69.0 m -105.69 148.55 36.63 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 125.47 1.508 . . . . 0.0 111.081 176.028 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -68.05 -16.04 44.24 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 123.977 3.118 . . . . 0.0 114.024 -173.236 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 17.5 m -76.91 8.61 3.59 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.812 1.245 . . . . 0.0 113.206 171.978 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 57.6 t30 71.31 46.07 0.45 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 127.805 2.442 . . . . 0.0 111.466 -177.246 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -131.38 -172.66 2.9 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.669 1.588 . . . . 0.0 110.27 -178.528 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.7 p -144.47 149.18 35.56 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.964 1.706 . . . . 0.0 110.526 -176.964 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -125.28 134.65 52.2 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.106 1.362 . . . . 0.0 111.314 176.229 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -78.84 133.0 37.04 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.988 0.915 . . . . 0.0 111.517 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 53.5 mt -107.65 -46.77 3.75 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.767 1.227 . . . . 0.0 112.714 -169.681 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -169.79 169.42 8.42 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.73 2.012 . . . . 0.0 110.482 -172.359 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -157.25 162.01 39.22 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.861 1.265 . . . . 0.0 113.163 -179.226 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -139.92 122.5 10.12 Favored Pre-proline 0 CA--C 1.547 0.839 0 C-N-CA 126.326 1.851 . . . . 0.0 110.1 174.699 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_exo . . . . . 0 C--N 1.351 0.661 0 CA-C-N 120.56 1.236 . . . . 0.0 113.719 -7.659 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 41.3 mtm180 . . . . . 0 CA--C 1.533 0.301 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -67.22 142.11 57.06 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.548 1.539 . . . . 0.0 110.968 168.847 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 85.0 mtm180 -143.85 148.75 35.94 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.997 1.719 . . . . 0.0 111.281 -174.825 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' VAL . . . . . 0.435 HG22 ' SD ' ' A' ' 108' ' ' MET . 40.2 t -126.49 126.33 68.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 125.451 1.5 . . . . 0.0 108.452 171.591 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 87.9 m -130.61 130.52 44.1 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.075 0.95 . . . . 0.0 110.996 178.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 65.4 tt0 -82.85 135.08 35.05 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 118.658 0.663 . . . . 0.0 110.042 169.501 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 37.1 mt -91.85 158.94 39.13 Favored Pre-proline 0 CA--C 1.543 0.681 0 C-N-CA 124.112 0.965 . . . . 0.0 112.205 -172.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -63.92 -6.88 11.9 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 123.64 2.893 . . . . 0.0 114.02 174.574 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -63.32 -26.15 68.63 Favored 'General case' 0 CA--C 1.55 0.974 0 CA-C-N 119.462 1.028 . . . . 0.0 112.155 168.872 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 91.19 -34.08 4.44 Favored Glycine 0 CA--C 1.531 1.037 0 C-N-CA 126.717 2.103 . . . . 0.0 113.938 175.155 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -126.84 73.44 1.41 Allowed 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.917 1.287 . . . . 0.0 109.48 171.376 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -178.37 146.0 0.36 Allowed 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 126.396 1.878 . . . . 0.0 110.742 -177.416 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -145.83 139.8 26.62 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.031 0.933 . . . . 0.0 111.773 -170.476 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -98.91 131.03 45.3 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.403 1.081 . . . . 0.0 111.85 169.842 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.435 ' SD ' HG22 ' A' ' 97' ' ' VAL . 20.8 mmt -108.98 103.24 12.23 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.983 2.113 . . . . 0.0 107.726 174.516 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 22.8 t -121.46 125.55 47.16 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 114.9 1.444 . . . . 0.0 114.9 -167.579 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 3.7 t -92.35 123.24 44.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 125.244 1.417 . . . . 0.0 108.229 168.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 87.6 t -82.89 128.4 38.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 168.674 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 44.3 ttt85 56.78 69.67 0.72 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.787 1.235 . . . . 0.0 112.07 171.03 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -74.35 134.48 42.5 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.409 1.083 . . . . 0.0 111.508 -177.324 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -108.63 163.03 13.6 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.032 1.733 . . . . 0.0 109.666 174.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 64.6 mtp85 -56.83 -28.01 60.94 Favored 'General case' 0 N--CA 1.478 0.947 0 O-C-N 121.021 -1.049 . . . . 0.0 113.74 179.116 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -61.46 -16.72 49.79 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.306 1.443 . . . . 0.0 114.623 171.441 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -89.68 -12.84 38.35 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.218 1.407 . . . . 0.0 113.634 178.88 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 48.1 m -64.74 138.16 58.22 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 120.815 -1.178 . . . . 0.0 112.132 -178.176 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 149.2 -165.8 29.43 Favored Glycine 0 N--CA 1.474 1.192 0 C-N-CA 124.13 0.871 . . . . 0.0 113.592 -176.718 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.5 m -91.23 142.66 27.48 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.165 1.386 . . . . 0.0 111.284 -174.903 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -138.78 160.82 38.76 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.678 1.991 . . . . 0.0 111.745 -178.265 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -156.29 147.12 21.96 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.603 1.161 . . . . 0.0 113.355 173.517 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 51.4 t -84.16 150.44 25.51 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.341 1.857 . . . . 0.0 110.704 173.156 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -161.43 129.52 2.13 Favored Glycine 0 N--CA 1.474 1.172 0 O-C-N 121.184 -0.947 . . . . 0.0 114.4 174.209 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -90.66 159.26 16.49 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.151 0.981 . . . . 0.0 112.197 178.638 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.507 HG22 HD21 ' A' ' 66' ' ' ASN . 17.2 tt -146.39 138.67 19.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 124.702 1.201 . . . . 0.0 109.781 170.515 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 7.3 m -81.11 161.48 24.1 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.763 0.825 . . . . 0.0 112.384 179.609 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 55.9 mt -78.6 -12.51 60.02 Favored 'General case' 0 N--CA 1.476 0.875 0 N-CA-C 114.115 1.154 . . . . 0.0 114.115 178.101 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -67.03 148.19 98.93 Favored Pre-proline 0 CA--C 1.553 1.064 0 C-N-CA 124.12 0.968 . . . . 0.0 112.532 179.072 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -55.96 -28.79 70.46 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 123.598 2.865 . . . . 0.0 114.601 176.135 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -85.14 4.42 34.45 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.747 1.219 . . . . 0.0 114.227 -179.063 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -63.09 159.17 17.88 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.99 1.108 . . . . 0.0 113.99 -176.727 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -150.63 166.54 30.02 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.73 2.012 . . . . 0.0 109.005 174.268 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 51.0 mt -73.11 114.16 12.05 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-O 121.584 0.707 . . . . 0.0 109.918 -178.155 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -81.47 88.37 6.16 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.991 1.716 . . . . 0.0 107.917 169.703 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -75.4 141.73 43.18 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.136 0.975 . . . . 0.0 112.354 -171.11 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 6.9 t -91.35 178.64 5.91 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.803 1.241 . . . . 0.0 111.848 169.198 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.6 pp -76.35 159.05 30.88 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.868 0.867 . . . . 0.0 112.061 174.292 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 91.0 mtm180 -83.58 150.54 25.87 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.251 1.02 . . . . 0.0 113.038 -174.753 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -136.93 169.62 17.47 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 127.164 2.186 . . . . 0.0 109.693 169.82 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -132.57 147.57 52.35 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 177.45 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 63.6 tp -107.41 134.46 50.42 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 126.982 2.113 . . . . 0.0 109.954 177.867 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 69.5 ttt180 -122.62 121.55 36.7 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 125.938 1.695 . . . . 0.0 109.885 171.393 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 44.2 t -103.39 117.6 49.09 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.704 1.202 . . . . 0.0 108.848 170.692 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 74.4 p -96.54 150.97 20.03 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.578 1.551 . . . . 0.0 110.24 177.849 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -64.03 142.74 58.3 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.328 0.585 . . . . 0.0 111.851 -178.619 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 54.1 ttp180 . . . . . 0 CA--C 1.535 0.372 0 C-N-CA 123.782 0.833 . . . . 0.0 110.147 179.291 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 66.6 p . . . . . 0 N--CA 1.471 0.615 0 CA-C-O 121.891 0.853 . . . . 0.0 112.043 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -144.14 124.66 13.98 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.043 1.737 . . . . 0.0 108.869 178.766 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 78.9 p -140.82 161.15 55.67 Favored Pre-proline 0 CA--C 1.55 0.95 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 -168.982 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -66.43 163.54 69.51 Favored 'Cis proline' 0 C--N 1.355 0.881 0 CA-C-N 119.572 0.883 . . . . 0.0 111.664 -7.509 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.78 -33.12 71.28 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 174.481 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.6 tt -136.34 124.32 22.82 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.61 1.564 . . . . 0.0 109.139 171.02 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.4 tp -106.75 130.3 54.49 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.75 1.22 . . . . 0.0 108.948 169.842 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 12.8 p -113.0 129.92 67.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 C-N-CA 124.007 0.923 . . . . 0.0 109.692 169.348 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.6 m -131.81 164.76 33.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 125.065 1.346 . . . . 0.0 111.348 174.022 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 16.8 m -89.87 149.02 22.83 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.553 1.141 . . . . 0.0 110.303 172.422 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -53.88 121.7 8.5 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.047 1.339 . . . . 0.0 111.015 175.657 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.24 4.12 78.01 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 125.486 1.517 . . . . 0.0 114.894 -176.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -95.71 150.21 20.63 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 119.577 1.688 . . . . 0.0 111.159 169.783 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -75.41 130.77 39.5 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.267 -0.896 . . . . 0.0 111.543 175.871 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -101.71 122.08 43.25 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 125.47 1.508 . . . . 0.0 110.174 175.419 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 60.5 m -128.16 124.35 36.62 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.023 0.929 . . . . 0.0 110.827 -178.422 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -102.45 159.54 15.34 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 127.21 2.204 . . . . 0.0 110.524 175.265 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 30.7 m -113.21 127.55 56.21 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.956 1.302 . . . . 0.0 110.006 177.793 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 53.1 t -111.66 142.02 44.51 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.785 1.634 . . . . 0.0 111.854 173.33 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.5 t -138.89 119.32 13.8 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.717 0.807 . . . . 0.0 111.309 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 . . . . . 0 N--CA 1.472 0.646 0 C-N-CA 126.235 1.814 . . . . 0.0 113.103 -179.939 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 55.2 p90 . . . . . 0 CA--C 1.54 0.565 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 90.7 t -95.97 134.77 32.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 125.672 1.589 . . . . 0.0 107.467 169.576 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.4 tp -99.33 145.84 26.9 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.705 1.202 . . . . 0.0 109.472 170.659 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -134.92 156.76 48.41 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.844 1.657 . . . . 0.0 111.984 -169.582 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 22.6 t90 -136.24 138.84 42.24 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.553 1.141 . . . . 0.0 112.103 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 48.6 m-85 -138.9 149.09 44.43 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.818 1.247 . . . . 0.0 114.009 -172.558 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -109.13 143.36 38.61 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.779 1.631 . . . . 0.0 108.531 167.566 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 31.7 mtp -84.58 143.92 28.98 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 119.437 1.017 . . . . 0.0 112.612 173.492 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 45.6 m -91.48 158.02 41.31 Favored Pre-proline 0 CA--C 1.548 0.901 0 C-N-CA 124.954 1.302 . . . . 0.0 111.601 173.476 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_exo -55.5 -32.39 82.3 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 123.983 3.122 . . . . 0.0 114.495 178.373 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.0 m -76.94 5.93 7.11 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 124.892 1.277 . . . . 0.0 113.845 177.965 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 73.99 20.94 2.71 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 127.828 2.451 . . . . 0.0 113.041 -176.852 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -89.4 -172.61 3.68 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.585 1.154 . . . . 0.0 110.287 169.97 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.1 p -144.06 146.96 33.18 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 125.597 1.559 . . . . 0.0 110.521 -176.351 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -121.96 132.42 54.53 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 125.077 1.351 . . . . 0.0 110.848 175.317 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 33.3 tttm -80.57 117.18 21.05 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.194 1.398 . . . . 0.0 110.9 -177.346 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 71.7 mt -90.07 -52.72 4.81 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 125.187 1.395 . . . . 0.0 111.253 -172.871 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -160.74 173.51 15.3 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.84 1.256 . . . . 0.0 111.79 -178.242 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -156.06 156.4 34.31 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.437 1.495 . . . . 0.0 111.798 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -142.0 129.46 11.5 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 125.004 1.322 . . . . 0.0 110.73 178.45 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo . . . . . 0 C--N 1.353 0.766 0 CA-C-N 120.498 1.214 . . . . 0.0 112.825 -8.315 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 48.1 mtp180 . . . . . 0 N--CA 1.467 0.422 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -97.7 119.71 36.77 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.221 1.409 . . . . 0.0 110.398 -174.07 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -139.48 145.67 39.06 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.416 1.086 . . . . 0.0 112.044 -169.964 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -126.56 135.95 62.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 125.153 1.381 . . . . 0.0 112.052 170.616 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 91.8 m -130.5 130.17 43.84 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.446 1.498 . . . . 0.0 110.756 -177.081 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -79.37 134.32 36.58 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.318 1.047 . . . . 0.0 110.371 173.429 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 36.4 mt -88.27 159.65 47.18 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 123.657 0.783 . . . . 0.0 111.829 178.199 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -63.4 -7.46 12.38 Favored 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 123.563 2.842 . . . . 0.0 113.979 173.528 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -67.23 -14.5 62.97 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 119.174 0.897 . . . . 0.0 112.946 169.157 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 83.98 -34.08 3.04 Favored Glycine 0 N--CA 1.473 1.123 0 C-N-CA 126.92 2.2 . . . . 0.0 114.343 172.092 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.67 73.59 1.46 Allowed 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 123.733 1.73 . . . . 0.0 109.669 173.349 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -174.89 141.72 0.62 Allowed 'General case' 0 C--O 1.237 0.418 0 C-N-CA 128.51 2.724 . . . . 0.0 108.095 -176.413 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -145.04 149.92 35.96 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.853 1.057 . . . . 0.0 113.853 -167.729 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -104.06 132.77 49.97 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.805 1.242 . . . . 0.0 110.479 167.813 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -112.87 123.31 50.02 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 126.652 1.981 . . . . 0.0 108.211 174.502 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 9.4 t -130.44 133.75 46.58 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 114.257 1.206 . . . . 0.0 114.257 -169.848 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 61.7 t -105.35 101.92 13.07 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 126.651 1.98 . . . . 0.0 106.817 168.7 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 98.0 t -73.2 125.53 32.3 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 123.66 0.784 . . . . 0.0 110.649 -177.629 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 72.3 mtt-85 51.08 70.42 0.53 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.597 1.959 . . . . 0.0 112.034 -177.617 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -66.34 134.09 51.86 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.79 1.636 . . . . 0.0 111.476 -178.249 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 8.3 mpt_? -108.38 166.68 10.58 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 126.11 1.764 . . . . 0.0 109.289 172.597 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 35.2 mtp180 -57.22 -30.2 64.39 Favored 'General case' 0 N--CA 1.478 0.962 0 O-C-N 121.033 -1.042 . . . . 0.0 113.619 -174.965 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -61.68 -19.39 62.29 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.464 1.506 . . . . 0.0 114.756 173.222 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 37.4 m-20 -84.59 -12.83 53.28 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 119.966 1.257 . . . . 0.0 113.481 177.223 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 48.4 m -63.1 143.85 57.42 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.734 1.152 . . . . 0.0 112.597 -179.466 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 143.42 -166.83 26.72 Favored Glycine 0 N--CA 1.474 1.173 0 O-C-N 121.262 -0.898 . . . . 0.0 113.469 -176.829 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.9 m -91.71 143.59 26.39 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 125.173 1.389 . . . . 0.0 111.08 -172.852 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -142.19 161.2 38.6 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.09 1.756 . . . . 0.0 111.57 -177.908 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -161.68 165.12 28.66 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.926 1.29 . . . . 0.0 113.054 177.351 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 13.6 t -108.79 156.65 19.38 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.974 1.709 . . . . 0.0 111.038 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -144.66 174.6 24.76 Favored Glycine 0 N--CA 1.47 0.959 0 C-N-CA 124.791 1.186 . . . . 0.0 113.436 176.274 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -152.45 159.24 43.39 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.184 0.994 . . . . 0.0 112.934 175.114 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 18.1 tt -152.22 135.01 6.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 125.463 1.505 . . . . 0.0 110.286 174.511 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 58.1 p -72.48 161.51 30.7 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.249 -0.907 . . . . 0.0 113.146 178.023 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 48.2 mt -75.58 -2.15 27.81 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 -179.029 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -68.07 150.83 97.6 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 124.611 1.164 . . . . 0.0 112.521 177.683 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_endo -69.51 -23.59 31.75 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.016 2.477 . . . . 0.0 112.787 176.894 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -91.38 8.1 37.83 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 125.088 1.355 . . . . 0.0 113.717 178.594 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.14 161.71 18.52 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.743 1.217 . . . . 0.0 113.922 -175.124 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -149.48 151.83 34.6 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.783 1.633 . . . . 0.0 109.251 178.233 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 51.2 mt -76.1 127.78 37.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 123.594 0.758 . . . . 0.0 111.957 -173.174 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -99.35 151.03 21.53 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.126 1.77 . . . . 0.0 109.328 168.097 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -132.54 149.12 52.37 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.27 1.028 . . . . 0.0 111.969 -172.427 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 60.6 p -87.6 177.85 6.94 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.858 1.263 . . . . 0.0 113.725 175.923 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -68.38 152.25 45.7 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.636 0.774 . . . . 0.0 109.208 166.75 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -82.12 152.84 26.36 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.113 0.965 . . . . 0.0 113.332 -177.405 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -124.67 169.66 11.75 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 127.158 2.183 . . . . 0.0 109.932 169.038 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -135.97 151.51 50.01 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 170.413 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 60.4 tp -112.87 132.91 55.1 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 126.704 2.002 . . . . 0.0 110.543 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 69.9 ttt180 -118.06 118.06 30.89 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.477 1.911 . . . . 0.0 109.663 171.437 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 42.4 t -102.3 116.67 46.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 123.82 0.848 . . . . 0.0 109.012 169.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 73.7 p -95.96 154.2 17.36 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.967 1.707 . . . . 0.0 110.606 178.251 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -64.61 145.61 55.91 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.641 -0.662 . . . . 0.0 112.32 -178.06 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 38.9 ttt85 . . . . . 0 N--CA 1.469 0.489 0 C-N-CA 124.476 1.111 . . . . 0.0 110.361 179.909 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.8 t . . . . . 0 N--CA 1.475 0.812 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.55 ' CE1' ' HB3' ' A' ' 123' ' ' CYS . 1.0 OUTLIER -125.99 136.52 53.08 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 125.522 1.529 . . . . 0.0 109.674 178.164 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 88.9 p -141.02 156.2 68.44 Favored Pre-proline 0 N--CA 1.478 0.935 0 N-CA-C 114.793 1.405 . . . . 0.0 114.793 -178.732 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -69.52 161.55 85.24 Favored 'Cis proline' 0 C--N 1.352 0.747 0 CA-C-N 119.307 0.788 . . . . 0.0 111.194 -10.411 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.47 -34.09 73.52 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 172.418 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 31.9 tp -132.83 121.14 22.51 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.757 1.623 . . . . 0.0 109.04 171.713 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 51.5 tp -105.09 130.38 53.29 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.63 1.172 . . . . 0.0 109.475 170.933 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.1 t -112.92 124.97 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 123.864 0.865 . . . . 0.0 109.104 173.087 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.3 m -127.22 166.36 24.1 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 C-N-CA 125.03 1.332 . . . . 0.0 111.828 173.417 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 45.4 m -91.47 147.16 23.22 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.337 1.055 . . . . 0.0 110.211 173.384 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 65.1 tt0 -53.96 116.44 2.56 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.79 1.636 . . . . 0.0 112.245 177.57 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 94.23 3.61 63.28 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 126.365 1.936 . . . . 0.0 114.825 -177.25 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 37.2 t0 -91.2 159.51 16.02 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 119.581 1.69 . . . . 0.0 111.622 172.507 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -85.32 130.58 34.56 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.224 -0.923 . . . . 0.0 111.373 172.263 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -103.01 133.83 47.47 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.923 1.689 . . . . 0.0 110.745 178.891 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 27.8 m -132.74 127.98 35.88 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.446 1.099 . . . . 0.0 111.906 178.879 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -105.36 159.56 15.81 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.222 2.209 . . . . 0.0 110.465 169.756 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 29.7 m -101.13 140.58 35.23 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.606 1.563 . . . . 0.0 109.182 169.56 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 17.4 t -131.53 131.94 43.78 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.697 1.599 . . . . 0.0 111.594 171.586 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 9.9 m -122.97 132.71 54.27 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.38 1.072 . . . . 0.0 111.109 179.271 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 . . . . . 0 N--CA 1.47 0.552 0 C-N-CA 126.168 1.787 . . . . 0.0 113.157 169.455 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 38.1 p90 . . . . . 0 CA--C 1.541 0.621 0 CA-C-O 120.905 0.383 . . . . 0.0 111.809 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 30.4 t -95.97 138.27 21.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 125.387 1.475 . . . . 0.0 107.594 170.699 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 9.0 tt -127.78 131.26 49.64 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.373 1.469 . . . . 0.0 109.583 -177.334 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -145.66 160.91 41.0 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 115.323 1.601 . . . . 0.0 115.323 -167.581 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 61.1 t-105 -113.94 148.84 36.16 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 126.585 1.954 . . . . 0.0 112.253 -179.723 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -141.14 146.63 37.27 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.528 1.531 . . . . 0.0 113.89 -172.239 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 34.3 ttp-105 -91.21 140.21 30.01 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.887 1.675 . . . . 0.0 108.152 167.646 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 21.1 mtp -86.6 136.75 32.93 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 119.328 0.967 . . . . 0.0 111.021 168.274 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 68.8 m -106.32 148.67 37.11 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 125.143 1.377 . . . . 0.0 110.986 177.187 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -68.45 -17.6 43.81 Favored 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 124.085 3.19 . . . . 0.0 113.711 -171.065 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.4 m -76.97 21.31 0.22 Allowed 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 125.278 1.431 . . . . 0.0 112.927 170.765 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 64.5 t30 64.35 39.99 6.79 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.685 2.394 . . . . 0.0 112.455 177.447 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -133.05 179.24 6.3 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.139 1.376 . . . . 0.0 111.001 -172.573 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.8 p -137.03 152.51 50.19 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 125.528 1.531 . . . . 0.0 111.043 -177.341 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -133.33 131.56 40.27 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.747 1.219 . . . . 0.0 110.88 178.373 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 5.4 ttpm? -78.91 132.43 36.75 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.553 0.741 . . . . 0.0 111.876 -173.355 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 83.9 mt -110.49 -46.82 3.35 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 125.038 1.335 . . . . 0.0 112.205 -171.524 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -152.84 160.02 43.07 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.39 1.076 . . . . 0.0 111.573 -179.655 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -154.07 149.05 26.74 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.513 1.125 . . . . 0.0 112.977 -172.368 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -136.02 126.8 16.79 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 125.916 1.686 . . . . 0.0 109.908 169.456 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo . . . . . 0 C--N 1.351 0.709 0 CA-C-N 120.275 1.134 . . . . 0.0 113.278 -10.733 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 47.8 mtp180 . . . . . 0 N--CA 1.469 0.507 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -95.98 133.63 39.97 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.222 1.009 . . . . 0.0 111.083 -176.368 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 66.2 mtm180 -143.33 152.24 41.41 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.174 0.99 . . . . 0.0 113.105 -171.359 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.8 t -121.61 130.61 74.45 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 126.483 1.913 . . . . 0.0 108.562 169.597 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 94.6 m -129.44 135.41 48.63 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 125.17 1.388 . . . . 0.0 110.444 -175.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -76.31 141.75 41.5 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.217 1.007 . . . . 0.0 111.519 178.78 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 96.4 mt -101.48 157.05 34.4 Favored Pre-proline 0 CA--C 1.542 0.661 0 C-N-CA 124.16 0.984 . . . . 0.0 111.582 170.35 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -70.39 -2.8 11.21 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 123.537 2.825 . . . . 0.0 113.527 173.573 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -72.46 -6.0 40.63 Favored 'General case' 0 CA--C 1.551 1.019 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -179.581 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 95.55 -31.92 6.72 Favored Glycine 0 CA--C 1.534 1.266 0 C-N-CA 126.019 1.771 . . . . 0.0 115.27 169.47 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 32.6 ptt180 -154.6 73.76 0.91 Allowed 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.546 1.538 . . . . 0.0 109.905 172.882 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -167.36 145.47 4.77 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 126.287 1.835 . . . . 0.0 108.925 -169.919 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -144.42 150.11 37.15 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -168.949 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -101.1 138.0 38.71 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.239 1.416 . . . . 0.0 110.111 167.474 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 6.9 mmt -123.51 117.84 26.02 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 126.545 1.938 . . . . 0.0 108.3 -176.002 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 71.0 p -131.27 148.7 52.72 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 115.602 1.704 . . . . 0.0 115.602 -169.991 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 22.1 t -118.66 102.76 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 C-N-CA 127.478 2.311 . . . . 0.0 107.233 176.55 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 58.6 t -78.02 131.86 33.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 124.006 0.923 . . . . 0.0 110.147 -178.015 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 3.7 tpt180 63.07 53.93 2.22 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.423 1.489 . . . . 0.0 111.198 175.738 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.43 123.61 22.75 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.573 1.149 . . . . 0.0 111.062 -174.392 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? -106.73 169.76 8.34 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 126.085 1.754 . . . . 0.0 110.295 177.61 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 22.2 mmm180 -49.19 -37.35 22.33 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.61 1.164 . . . . 0.0 113.84 -175.793 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -60.07 -25.09 65.1 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 125.271 1.429 . . . . 0.0 114.697 175.92 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 -81.8 -1.87 48.88 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.896 1.278 . . . . 0.0 113.272 178.44 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 33.1 m -70.32 124.04 23.18 Favored 'General case' 0 CA--C 1.543 0.699 0 O-C-N 120.18 -1.575 . . . . 0.0 111.238 173.749 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 165.96 -171.48 41.08 Favored Glycine 0 N--CA 1.474 1.173 0 O-C-N 121.682 -0.636 . . . . 0.0 114.306 -177.068 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.0 m -88.9 139.72 30.17 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.725 1.21 . . . . 0.0 110.714 -179.254 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -144.2 157.67 44.16 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.046 1.738 . . . . 0.0 111.007 -177.376 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.5 pp -155.16 165.36 36.93 Favored 'General case' 0 N--CA 1.469 0.478 0 O-C-N 121.25 -0.906 . . . . 0.0 113.243 -178.648 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 123' ' ' CYS . . . . . 0.55 ' HB3' ' CE1' ' A' ' 37' ' ' PHE . 48.4 t -111.16 156.12 21.88 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.243 1.417 . . . . 0.0 110.574 175.064 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -144.51 167.95 26.89 Favored Glycine 0 CA--C 1.524 0.653 0 C-N-CA 124.496 1.046 . . . . 0.0 112.536 171.643 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -145.13 149.34 34.83 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.869 0.868 . . . . 0.0 111.844 175.334 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.4 tt -148.9 133.08 8.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 125.452 1.501 . . . . 0.0 110.842 -176.091 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 14.5 m -66.39 159.58 26.61 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.397 1.079 . . . . 0.0 112.656 179.604 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 29.4 mt -73.28 -14.38 61.3 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.213 1.19 . . . . 0.0 114.213 -174.735 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -72.35 143.03 85.09 Favored Pre-proline 0 CA--C 1.552 1.054 0 C-N-CA 124.294 1.037 . . . . 0.0 112.329 177.65 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -56.22 -27.01 64.07 Favored 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 123.829 3.019 . . . . 0.0 115.153 177.782 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -78.81 -4.34 48.96 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 -178.575 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.97 169.49 13.18 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 124.891 1.276 . . . . 0.0 113.766 -176.894 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -149.76 162.48 40.18 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.157 1.783 . . . . 0.0 110.21 175.739 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 10.0 mm -73.08 123.44 27.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-O 121.756 0.789 . . . . 0.0 111.757 -178.217 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -84.67 143.29 29.31 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 126.799 2.04 . . . . 0.0 110.171 169.636 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -134.14 158.85 42.6 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.594 1.558 . . . . 0.0 112.188 -172.12 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 5.9 t -140.21 -163.88 1.6 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.784 1.234 . . . . 0.0 111.664 169.733 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -65.89 114.34 5.04 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.545 1.538 . . . . 0.0 110.424 -178.695 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 1.4 ptp180 -71.43 154.74 41.31 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 125.372 1.469 . . . . 0.0 112.939 -177.896 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.89 169.63 9.09 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.633 1.973 . . . . 0.0 111.225 -171.809 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -136.51 146.84 46.69 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 122.228 1.013 . . . . 0.0 112.956 175.87 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 58.4 tp -109.69 134.29 52.14 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 127.1 2.16 . . . . 0.0 109.531 179.41 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 70.6 ttt180 -121.12 123.91 43.46 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 125.937 1.695 . . . . 0.0 109.574 171.775 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 53.9 t -103.07 120.44 52.93 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 C-N-CA 124.497 1.119 . . . . 0.0 108.132 169.453 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 54.7 p -93.29 147.53 22.83 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.289 1.436 . . . . 0.0 109.411 174.099 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -59.86 148.07 36.1 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.444 0.698 . . . . 0.0 112.244 -174.933 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 60.1 ttp180 . . . . . 0 C--O 1.238 0.45 0 C-N-CA 125.016 1.326 . . . . 0.0 110.199 -170.947 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.2 t . . . . . 0 N--CA 1.476 0.858 0 CA-C-O 120.52 0.2 . . . . 0.0 111.395 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -122.52 135.36 54.63 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.166 1.386 . . . . 0.0 110.776 -172.622 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 94.2 p -141.01 157.14 67.84 Favored Pre-proline 0 CA--C 1.55 0.98 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -179.007 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -69.84 162.58 84.05 Favored 'Cis proline' 0 C--N 1.353 0.809 0 CA-C-N 118.919 0.65 . . . . 0.0 111.279 -9.349 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.33 -34.1 71.94 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 171.886 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 53.2 tp -140.16 122.91 16.4 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.433 1.493 . . . . 0.0 109.41 172.194 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.9 tp -105.16 127.23 52.81 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.76 1.624 . . . . 0.0 109.186 171.715 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.8 t -111.05 124.5 67.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 123.912 0.885 . . . . 0.0 108.879 172.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.1 m -129.38 168.14 23.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 C-N-CA 124.935 1.294 . . . . 0.0 111.567 172.933 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 23.4 m -92.33 151.67 20.17 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.165 1.386 . . . . 0.0 110.44 173.987 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -52.13 123.89 11.68 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.436 1.094 . . . . 0.0 110.7 169.026 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 89.5 -2.92 83.43 Favored Glycine 0 CA--C 1.533 1.16 0 C-N-CA 125.616 1.579 . . . . 0.0 114.762 -177.614 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -91.31 158.39 16.58 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 119.393 1.597 . . . . 0.0 112.012 175.646 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -87.65 123.59 32.65 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.171 0.988 . . . . 0.0 110.901 178.555 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -101.59 129.96 47.81 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.955 1.302 . . . . 0.0 110.534 177.072 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 27.1 m -131.7 128.02 38.09 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.407 1.083 . . . . 0.0 111.021 177.919 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -102.8 154.5 19.12 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 126.628 1.971 . . . . 0.0 110.505 169.932 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 65.4 m -107.37 134.15 50.85 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.172 1.389 . . . . 0.0 109.001 170.706 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 73.2 m -130.05 114.73 16.14 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.653 1.181 . . . . 0.0 110.337 175.575 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 22.6 t -97.4 154.65 17.33 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 125.142 1.377 . . . . 0.0 110.237 179.61 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 53.8 m-85 . . . . . 0 CA--C 1.536 0.412 0 C-N-CA 124.742 1.217 . . . . 0.0 113.979 -169.944 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 38.5 p90 . . . . . 0 CA--C 1.539 0.535 0 CA-C-O 121.128 0.49 . . . . 0.0 112.031 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.7 t -95.95 133.08 38.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 125.513 1.525 . . . . 0.0 108.178 169.763 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.32 129.46 45.53 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.445 1.098 . . . . 0.0 108.694 169.264 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 -125.52 147.75 49.14 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.108 1.363 . . . . 0.0 111.133 179.081 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 18.9 t90 -122.02 139.39 53.75 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.482 1.113 . . . . 0.0 111.473 176.861 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -135.44 144.84 46.68 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.496 1.118 . . . . 0.0 113.859 -170.739 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.4 ttt-85 -106.54 134.97 48.86 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.516 1.126 . . . . 0.0 108.85 167.556 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.95 130.36 34.49 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.679 1.592 . . . . 0.0 110.614 170.643 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 19.0 m -104.31 158.79 31.2 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 126.014 1.725 . . . . 0.0 111.727 179.648 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -67.71 -17.42 47.65 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 123.986 3.124 . . . . 0.0 113.98 -174.625 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 70.6 m -80.08 21.94 0.55 Allowed 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 124.33 1.052 . . . . 0.0 112.28 168.969 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . 0.274 0.9 OUTLIER 54.31 33.85 19.28 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 128.147 2.579 . . . . 0.0 114.561 179.265 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -118.01 158.9 24.12 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.793 1.237 . . . . 0.0 111.397 178.737 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.3 p -113.0 144.35 42.74 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 125.815 1.646 . . . . 0.0 109.79 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -129.04 130.69 46.91 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 123.636 0.774 . . . . 0.0 111.313 177.91 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 32.0 ttmt -74.24 121.15 20.82 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.688 1.195 . . . . 0.0 110.355 -178.065 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 80.2 mt -94.48 -47.57 6.5 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 125.51 1.524 . . . . 0.0 111.911 -170.752 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -167.84 170.5 10.67 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 127.287 2.235 . . . . 0.0 109.18 -177.461 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.65 161.78 35.04 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.181 0.992 . . . . 0.0 112.451 -171.124 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -144.18 118.5 5.92 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.872 1.269 . . . . 0.0 111.131 169.879 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo . . . . . 0 C--N 1.352 0.715 0 CA-C-N 120.027 1.045 . . . . 0.0 112.166 -11.571 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 12.2 ptp180 . . . . . 0 N--CA 1.472 0.671 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -93.77 137.42 33.03 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.49 1.116 . . . . 0.0 112.171 -173.173 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 72.1 mtm180 -140.72 151.51 44.56 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.804 1.241 . . . . 0.0 112.607 -179.187 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 59.0 t -126.51 126.65 69.37 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 126.078 1.751 . . . . 0.0 109.002 169.035 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 99.5 m -118.53 132.55 56.21 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.736 1.614 . . . . 0.0 109.78 176.588 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.17 141.74 28.32 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.617 1.167 . . . . 0.0 111.949 176.572 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 32.1 mt -97.77 157.98 33.74 Favored Pre-proline 0 CA--C 1.544 0.723 0 C-N-CA 123.749 0.82 . . . . 0.0 111.149 175.421 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -65.66 -5.02 10.81 Favored 'Trans proline' 0 CA--C 1.541 0.858 0 C-N-CA 123.411 2.741 . . . . 0.0 114.369 177.262 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -66.53 -25.99 66.93 Favored 'General case' 0 CA--C 1.55 0.947 0 CA-C-N 119.793 1.178 . . . . 0.0 112.428 169.504 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 86.68 -27.27 5.94 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 125.619 1.58 . . . . 0.0 114.04 178.342 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -130.91 73.34 1.54 Allowed 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 122.849 1.309 . . . . 0.0 108.664 171.509 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 13.2 t0 178.99 136.57 0.09 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.907 2.083 . . . . 0.0 108.596 -173.676 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -148.59 152.23 36.4 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.86 0.864 . . . . 0.0 112.773 -168.062 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 -113.62 127.06 55.92 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.169 1.388 . . . . 0.0 109.63 168.387 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 2.4 mpt? -119.1 136.51 54.12 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.622 1.169 . . . . 0.0 109.684 -179.191 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 50.4 p -141.98 147.3 36.74 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 116.122 1.897 . . . . 0.0 116.122 -169.481 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 21.9 t -103.52 109.09 26.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 126.642 1.977 . . . . 0.0 107.302 170.021 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 91.9 t -76.11 127.55 37.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 124.493 1.117 . . . . 0.0 109.423 175.632 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 53.6 ttt85 53.88 59.5 4.24 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.147 1.379 . . . . 0.0 110.955 176.852 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.47 150.7 47.91 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.836 0.854 . . . . 0.0 112.434 -171.537 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.95 162.63 31.53 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.934 1.693 . . . . 0.0 110.686 -179.406 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 76.9 mtm180 -55.88 -22.37 25.11 Favored 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 114.474 1.287 . . . . 0.0 114.474 -177.421 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -55.28 -37.96 67.98 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.846 1.258 . . . . 0.0 112.835 168.254 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -80.97 -26.16 36.8 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.215 1.006 . . . . 0.0 113.096 -169.118 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 46.4 m -49.74 138.41 14.56 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.935 1.294 . . . . 0.0 112.963 178.177 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 155.7 -164.26 32.08 Favored Glycine 0 N--CA 1.472 1.037 0 C-N-CA 123.88 0.753 . . . . 0.0 113.198 -176.833 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 21.9 m -89.95 144.61 25.77 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.276 1.031 . . . . 0.0 109.293 175.479 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 34.2 m-85 -135.65 158.36 44.57 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.6 1.56 . . . . 0.0 112.174 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -160.87 151.9 18.74 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 124.953 1.301 . . . . 0.0 112.3 175.26 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 85.3 m -103.39 170.76 7.76 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.787 1.235 . . . . 0.0 110.969 173.073 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -164.82 140.24 6.3 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 121.258 -0.901 . . . . 0.0 114.078 172.215 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -104.34 142.98 33.61 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.562 1.145 . . . . 0.0 111.124 173.987 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.0 tt -145.47 134.42 17.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 124.209 1.003 . . . . 0.0 111.057 176.59 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 2.2 m -64.24 160.88 17.66 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.735 1.214 . . . . 0.0 112.828 -179.508 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 37.2 mt -72.46 -17.57 61.76 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 -178.19 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -69.1 148.92 97.77 Favored Pre-proline 0 CA--C 1.551 0.998 0 C-N-CA 124.522 1.129 . . . . 0.0 112.48 178.137 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -69.55 -20.29 36.0 Favored 'Trans proline' 0 CA--C 1.539 0.764 0 C-N-CA 123.144 2.563 . . . . 0.0 113.214 179.579 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -83.04 0.44 44.85 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 124.803 1.241 . . . . 0.0 113.97 178.126 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.9 167.98 14.56 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.126 1.371 . . . . 0.0 113.928 -175.848 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -145.77 152.01 38.87 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.81 1.644 . . . . 0.0 109.546 177.044 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 51.2 mt -75.57 126.95 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 124.187 0.995 . . . . 0.0 111.215 -174.53 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -78.4 88.49 4.4 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.767 1.227 . . . . 0.0 109.967 169.723 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -83.79 158.78 21.59 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.914 1.285 . . . . 0.0 111.154 175.83 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 6.7 t -148.61 -170.0 3.5 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.201 1.0 . . . . 0.0 112.152 173.745 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 98.8 mt -60.5 128.82 38.55 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.193 1.797 . . . . 0.0 111.754 -174.479 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.43 154.45 41.34 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.758 1.223 . . . . 0.0 112.73 -171.979 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.84 167.16 11.19 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 127.069 2.148 . . . . 0.0 110.234 174.239 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -135.06 143.41 46.68 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.026 -1.046 . . . . 0.0 111.781 179.26 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 60.6 tp -112.17 134.14 53.89 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 125.922 1.689 . . . . 0.0 110.3 172.49 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 70.8 ttt180 -124.87 117.96 25.26 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.501 1.52 . . . . 0.0 109.615 169.545 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 29.5 t -100.53 117.7 46.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 124.37 1.068 . . . . 0.0 108.685 169.605 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 66.8 p -97.44 154.65 17.34 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.698 1.599 . . . . 0.0 111.056 179.4 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -62.02 141.98 57.76 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.527 0.731 . . . . 0.0 112.629 -176.523 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 51.8 ttt85 . . . . . 0 N--CA 1.467 0.423 0 C-N-CA 123.914 0.885 . . . . 0.0 110.164 -178.005 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 37.8 m . . . . . 0 N--CA 1.474 0.748 0 CA-C-O 121.094 0.473 . . . . 0.0 111.378 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -116.8 129.23 55.97 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.6 1.96 . . . . 0.0 109.576 170.967 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 67.8 m -140.79 158.94 64.24 Favored Pre-proline 0 N--CA 1.479 0.98 0 C-N-CA 124.543 1.137 . . . . 0.0 113.14 -170.062 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -67.75 157.5 85.46 Favored 'Cis proline' 0 C--N 1.354 0.833 0 CA-C-N 119.938 1.014 . . . . 0.0 111.398 -5.383 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -55.03 -25.92 33.67 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.109 0.963 . . . . 0.0 113.5 176.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 43.3 tp -143.5 116.18 8.69 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.582 1.553 . . . . 0.0 108.441 168.698 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 38.0 tp -97.32 127.47 43.31 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.416 1.086 . . . . 0.0 109.018 169.848 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.8 t -114.04 123.14 69.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 124.067 0.947 . . . . 0.0 108.662 173.232 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 32.6 m -127.03 162.52 31.72 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 124.529 1.132 . . . . 0.0 112.134 174.013 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 11.6 m -87.52 148.65 24.82 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.378 1.071 . . . . 0.0 110.502 173.076 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -59.2 125.7 24.69 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.019 0.928 . . . . 0.0 111.753 -179.254 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.66 -3.49 85.02 Favored Glycine 0 CA--C 1.532 1.11 0 C-N-CA 125.805 1.669 . . . . 0.0 114.51 -175.433 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -85.35 156.03 21.07 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 119.601 1.7 . . . . 0.0 110.814 171.744 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -82.46 134.81 35.22 Favored 'General case' 0 CA--C 1.543 0.68 0 O-C-N 121.405 -0.809 . . . . 0.0 111.24 171.98 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -104.47 123.64 47.84 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.713 1.605 . . . . 0.0 110.052 177.342 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 94.7 m -122.9 125.22 44.93 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.41 0.684 . . . . 0.0 110.985 176.911 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -102.82 159.6 15.34 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 127.264 2.225 . . . . 0.0 110.522 174.363 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 80.6 m -105.71 130.08 53.79 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.854 1.261 . . . . 0.0 109.997 170.42 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 54.0 t -110.29 140.5 44.39 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.382 1.473 . . . . 0.0 109.814 168.985 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 6.1 t -144.38 132.24 21.38 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.355 -0.84 . . . . 0.0 110.534 -178.837 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 . . . . . 0 N--CA 1.468 0.449 0 C-N-CA 125.645 1.578 . . . . 0.0 113.636 -177.217 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 52.4 p90 . . . . . 0 CA--C 1.54 0.589 0 CA-C-O 120.407 0.146 . . . . 0.0 110.611 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 50.4 t -95.92 125.22 48.78 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.43 1.092 . . . . 0.0 108.268 174.098 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 58.6 tp -101.57 128.9 47.62 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.388 0.675 . . . . 0.0 109.557 169.887 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 28.8 m-80 -116.64 163.17 16.51 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.637 1.575 . . . . 0.0 111.154 -175.777 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 19.8 t90 -133.19 138.88 46.73 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.756 1.222 . . . . 0.0 111.832 -178.376 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -137.43 146.56 44.51 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.291 1.436 . . . . 0.0 113.717 -172.073 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 27.7 ttp-105 -104.12 142.62 34.17 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.949 1.7 . . . . 0.0 107.727 167.383 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 35.4 mtp -88.27 131.47 34.77 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 119.077 0.853 . . . . 0.0 111.027 170.075 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 37.9 m -92.65 155.56 41.84 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 124.807 1.243 . . . . 0.0 111.43 175.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -66.67 -19.32 53.88 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 123.566 2.844 . . . . 0.0 113.775 -175.22 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.7 m -76.94 8.54 3.69 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 124.753 1.221 . . . . 0.0 113.277 171.395 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 26.4 m120 73.29 21.01 3.13 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 127.851 2.46 . . . . 0.0 113.37 179.231 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 21.9 mm100 -96.7 175.37 6.4 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.669 1.187 . . . . 0.0 111.265 174.813 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.2 p -126.53 139.84 52.9 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.976 1.71 . . . . 0.0 109.795 175.251 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 41.3 t0 -120.57 130.68 54.31 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 125.323 1.449 . . . . 0.0 110.667 -177.857 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 41.7 tttm -82.79 123.12 29.04 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.454 1.102 . . . . 0.0 111.415 -171.435 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.5 mt -100.37 -45.65 5.51 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.77 1.228 . . . . 0.0 112.912 -169.069 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -174.05 176.71 2.5 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.337 1.855 . . . . 0.0 110.353 -178.778 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -157.75 166.29 33.15 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.959 1.303 . . . . 0.0 112.136 -179.583 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 21.2 t80 -142.17 122.24 8.18 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 125.087 1.355 . . . . 0.0 110.503 172.586 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo . . . . . 0 C--N 1.352 0.715 0 CA-C-N 119.534 0.869 . . . . 0.0 110.92 -9.363 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 50.6 mtp180 . . . . . 0 N--CA 1.473 0.684 0 CA-C-O 119.127 -0.464 . . . . 0.0 112.049 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 88.6 m-85 -103.23 128.3 50.27 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.554 1.542 . . . . 0.0 110.903 -175.665 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -142.02 148.04 37.86 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.766 1.227 . . . . 0.0 111.406 -170.44 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 40.9 t -126.62 136.9 59.47 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 124.976 1.311 . . . . 0.0 110.784 178.497 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 98.0 m -127.81 132.74 49.43 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.494 1.518 . . . . 0.0 110.212 175.312 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -85.12 136.48 33.53 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.08 0.952 . . . . 0.0 110.46 172.11 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 29.5 mt -89.59 159.25 44.22 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 124.135 0.974 . . . . 0.0 111.461 176.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -63.65 -6.03 9.83 Favored 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 123.489 2.793 . . . . 0.0 114.216 175.097 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -66.55 -18.99 65.67 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-N 119.224 0.92 . . . . 0.0 112.953 169.391 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 82.72 -34.18 2.76 Favored Glycine 0 N--CA 1.474 1.2 0 C-N-CA 127.386 2.422 . . . . 0.0 114.326 174.222 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 38.1 mtm105 -128.25 73.56 1.49 Allowed 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.097 1.359 . . . . 0.0 108.574 168.534 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -174.22 137.68 0.54 Allowed 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 127.743 2.417 . . . . 0.0 108.03 177.514 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -146.03 148.5 32.77 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 123.461 0.705 . . . . 0.0 112.209 -168.037 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 42.6 m170 -105.43 130.2 53.57 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.71 1.204 . . . . 0.0 111.203 169.325 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -112.0 119.31 38.04 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 126.311 1.844 . . . . 0.0 108.565 178.088 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 60.8 m -121.44 125.66 47.42 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 -169.479 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 25.8 t -96.35 111.11 25.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 125.773 1.629 . . . . 0.0 106.693 168.185 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 62.6 t -81.48 127.92 39.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 123.543 0.737 . . . . 0.0 109.766 177.536 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 68.0 ttt-85 57.15 67.61 0.96 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.821 1.649 . . . . 0.0 111.273 176.948 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -72.53 144.42 47.97 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.851 0.86 . . . . 0.0 112.289 -174.137 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 49.0 mmm-85 -123.15 162.23 22.91 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 126.625 1.97 . . . . 0.0 110.352 -177.092 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 77.2 mtm180 -55.66 -23.11 26.33 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 113.66 0.985 . . . . 0.0 113.66 174.889 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -54.06 -35.67 62.28 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.766 1.626 . . . . 0.0 113.586 168.271 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -87.69 -15.09 38.12 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.304 1.042 . . . . 0.0 113.72 -168.857 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 50.2 m -58.04 134.66 56.61 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 119.696 1.135 . . . . 0.0 112.273 177.894 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 146.94 -163.97 28.59 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 124.496 1.046 . . . . 0.0 113.316 -171.783 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.8 m -95.08 144.85 25.4 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.586 1.154 . . . . 0.0 111.783 -173.951 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -140.5 156.92 46.18 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.394 1.877 . . . . 0.0 112.254 -179.097 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -164.07 159.16 20.19 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.797 1.639 . . . . 0.0 112.372 179.664 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 7.3 p -112.49 162.99 15.0 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.543 1.137 . . . . 0.0 112.115 176.037 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -153.35 126.23 1.92 Allowed Glycine 0 N--CA 1.471 1.026 0 O-C-N 121.304 -0.872 . . . . 0.0 114.287 -176.569 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -97.23 148.78 22.75 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.484 1.114 . . . . 0.0 112.715 -177.932 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 17.8 tt -150.27 138.8 14.78 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 125.402 1.481 . . . . 0.0 110.532 175.788 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 47.4 t -65.2 158.15 26.91 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.451 -0.781 . . . . 0.0 112.72 176.427 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -71.76 -8.04 51.79 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 172.542 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -69.77 147.59 96.3 Favored Pre-proline 0 CA--C 1.552 1.04 0 C-N-CA 124.453 1.101 . . . . 0.0 112.275 175.75 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -71.02 -21.24 27.9 Favored 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 123.17 2.58 . . . . 0.0 113.311 -179.113 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -87.74 3.5 47.78 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.735 1.214 . . . . 0.0 113.821 179.529 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.76 167.31 17.42 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.147 1.379 . . . . 0.0 114.126 -173.689 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -150.45 148.86 29.26 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.221 1.808 . . . . 0.0 109.169 178.556 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 47.8 mt -77.15 131.12 35.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 124.219 1.008 . . . . 0.0 112.031 -170.383 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -101.32 117.11 34.31 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.594 1.557 . . . . 0.0 108.284 168.67 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -94.93 148.86 21.87 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.235 1.014 . . . . 0.0 112.134 -174.452 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 52.9 p -83.91 169.22 15.29 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.693 1.197 . . . . 0.0 114.074 178.224 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 94.5 mt -69.06 129.99 41.48 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 166.903 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 34.3 ptt-85 -84.68 164.15 18.79 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.931 1.292 . . . . 0.0 113.749 -169.683 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -146.93 163.13 37.14 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.283 1.433 . . . . 0.0 113.488 -177.882 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -99.13 151.48 20.93 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.726 1.61 . . . . 0.0 112.798 -176.837 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 61.5 tp -125.58 136.49 53.35 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 126.857 2.063 . . . . 0.0 109.851 169.674 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -128.11 120.46 27.44 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.7 1.6 . . . . 0.0 109.93 174.031 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 42.9 t -101.95 116.93 46.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 124.512 1.125 . . . . 0.0 108.752 169.721 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 82.8 p -101.98 145.37 29.37 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.653 1.581 . . . . 0.0 110.716 -178.932 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -55.36 145.22 22.78 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -175.797 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 63.7 ttt-85 . . . . . 0 N--CA 1.467 0.389 0 C-N-CA 125.209 1.404 . . . . 0.0 109.772 175.675 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.2 t . . . . . 0 N--CA 1.472 0.658 0 CA-C-O 121.503 0.668 . . . . 0.0 112.202 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -144.97 117.67 8.67 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.347 1.859 . . . . 0.0 109.619 175.746 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 96.9 p -140.94 161.72 52.29 Favored Pre-proline 0 CA--C 1.55 0.969 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 -169.684 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -71.71 164.26 84.65 Favored 'Cis proline' 0 C--N 1.354 0.826 0 CA-C-N 119.45 0.839 . . . . 0.0 111.762 -7.791 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.66 -26.06 68.49 Favored 'General case' 0 CA--C 1.544 0.75 0 N-CA-C 113.048 0.759 . . . . 0.0 113.048 173.895 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 50.7 tp -144.3 125.68 14.8 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.192 1.797 . . . . 0.0 109.326 172.872 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 64.7 tp -115.29 125.61 53.48 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.987 1.715 . . . . 0.0 109.266 174.304 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.9 t -110.25 122.98 65.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 124.144 0.978 . . . . 0.0 109.16 175.038 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 32.0 m -129.2 176.22 8.75 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 125.753 1.621 . . . . 0.0 111.861 176.456 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 26.1 m -103.95 151.68 22.88 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 126.08 1.752 . . . . 0.0 110.402 176.034 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -53.51 121.98 8.82 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.294 1.038 . . . . 0.0 111.777 171.72 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.0 2.36 69.1 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 125.442 1.496 . . . . 0.0 114.407 -177.089 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -93.85 149.37 21.29 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.665 1.732 . . . . 0.0 112.544 177.588 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -72.93 113.22 9.72 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.255 1.022 . . . . 0.0 110.757 172.888 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -97.5 124.99 41.92 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.79 0.836 . . . . 0.0 110.514 177.63 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 32.1 m -129.53 123.27 31.02 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 118.633 0.651 . . . . 0.0 111.53 -173.525 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -101.55 149.81 23.72 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.609 1.564 . . . . 0.0 110.371 169.651 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 62.1 m -102.67 126.34 49.73 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.985 1.314 . . . . 0.0 109.475 177.454 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 37.5 t -124.33 142.05 51.58 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.147 1.379 . . . . 0.0 112.314 175.514 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 80.7 p -150.59 148.79 29.07 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.146 -0.971 . . . . 0.0 112.133 170.327 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 . . . . . 0 CA--C 1.537 0.451 0 C-N-CA 126.822 2.049 . . . . 0.0 111.962 178.486 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 55.5 p90 . . . . . 0 CA--C 1.54 0.577 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.7 t -96.03 129.02 46.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 125.179 1.392 . . . . 0.0 107.995 170.058 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 34.1 tp -99.37 140.29 33.77 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.222 1.009 . . . . 0.0 109.968 171.294 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -135.49 146.37 48.08 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.337 1.455 . . . . 0.0 111.02 -170.75 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 17.3 t90 -118.37 139.9 50.67 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.031 1.332 . . . . 0.0 111.297 177.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -136.99 147.7 46.44 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.725 1.21 . . . . 0.0 113.783 -172.94 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 74.4 ttt180 -105.68 140.06 39.31 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.41 1.484 . . . . 0.0 108.315 167.503 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 29.8 mtp -81.82 145.92 30.16 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.011 0.823 . . . . 0.0 112.414 177.882 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 67.7 m -104.68 148.91 36.83 Favored Pre-proline 0 CA--C 1.544 0.745 0 C-N-CA 125.657 1.583 . . . . 0.0 110.793 173.408 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -67.16 -17.9 50.73 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 123.682 2.921 . . . . 0.0 113.278 -177.715 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 12.0 m -76.87 19.25 0.3 Allowed 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 125.759 1.624 . . . . 0.0 113.29 171.914 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 44.8 m-80 68.63 33.84 3.72 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 127.425 2.29 . . . . 0.0 112.587 177.01 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -130.06 -172.68 2.84 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.453 1.501 . . . . 0.0 110.798 -172.121 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.1 p -148.01 145.12 28.38 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.909 1.684 . . . . 0.0 110.215 -171.494 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -120.12 131.61 55.11 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 124.638 1.175 . . . . 0.0 111.002 175.281 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -76.17 129.51 36.85 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.561 0.744 . . . . 0.0 111.307 -179.359 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 55.7 mt -101.98 -51.25 3.45 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 125.473 1.509 . . . . 0.0 111.406 -173.165 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -163.4 173.55 13.05 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.822 1.649 . . . . 0.0 110.387 -175.37 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.6 168.39 26.21 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.508 1.123 . . . . 0.0 112.759 -174.871 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 52.3 t80 -142.73 122.8 7.98 Favored Pre-proline 0 CA--C 1.546 0.8 0 C-N-CA 124.992 1.317 . . . . 0.0 110.332 169.439 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo . . . . . 0 C--N 1.351 0.705 0 CA-C-N 119.683 0.922 . . . . 0.0 111.399 -8.648 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 . . . . . 0 N--CA 1.474 0.726 0 N-CA-C 113.693 0.997 . . . . 0.0 113.693 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -90.15 124.94 35.25 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.04 0.936 . . . . 0.0 112.944 -168.111 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 23.4 mmt85 -129.82 156.63 44.03 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.84 1.656 . . . . 0.0 111.831 178.137 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 87.7 t -126.6 130.53 71.69 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 C-N-CA 125.65 1.58 . . . . 0.0 109.771 169.774 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 97.8 m -126.0 132.0 52.11 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 125.08 1.352 . . . . 0.0 110.16 177.489 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 63.0 tt0 -84.64 138.02 32.93 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.597 1.159 . . . . 0.0 111.043 177.465 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 28.6 mt -91.55 162.37 31.78 Favored Pre-proline 0 CA--C 1.548 0.877 0 C-N-CA 124.102 0.961 . . . . 0.0 112.063 176.31 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -56.03 -20.88 32.02 Favored 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 124.213 3.276 . . . . 0.0 114.211 172.605 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 21.7 m120 -60.74 -18.44 54.6 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 176.627 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 90.48 -34.06 4.32 Favored Glycine 0 N--CA 1.474 1.196 0 C-N-CA 126.569 2.033 . . . . 0.0 114.549 169.878 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 26.0 ptt-85 -138.8 73.58 1.44 Allowed 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 123.883 1.802 . . . . 0.0 109.72 168.458 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -164.53 137.33 4.84 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 127.872 2.469 . . . . 0.0 106.52 -179.058 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -144.75 143.47 30.69 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -166.628 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -96.69 116.03 28.43 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.973 1.309 . . . . 0.0 110.322 168.957 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -94.55 108.05 20.01 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 126.558 1.943 . . . . 0.0 107.621 174.336 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 19.4 m -116.51 126.99 54.14 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.847 1.055 . . . . 0.0 113.847 -167.488 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 21.3 t -94.66 104.83 16.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 N-CA-C 106.722 -1.584 . . . . 0.0 106.722 168.051 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 81.0 t -70.4 121.08 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 124.647 1.179 . . . . 0.0 109.731 179.442 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 51.87 57.27 6.7 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.793 1.637 . . . . 0.0 112.039 176.32 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -59.57 140.04 56.66 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.254 1.422 . . . . 0.0 112.056 -173.086 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 19.8 mmm-85 -115.05 168.31 10.04 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.641 1.576 . . . . 0.0 110.508 177.757 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 59.0 mtp85 -51.2 -35.29 35.78 Favored 'General case' 0 N--CA 1.479 0.997 0 O-C-N 121.023 -1.048 . . . . 0.0 112.855 176.149 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -57.43 -22.59 44.26 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.14 1.776 . . . . 0.0 114.994 173.115 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -86.68 -10.88 52.78 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.774 1.229 . . . . 0.0 113.53 177.042 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 65.4 m -63.97 137.74 58.14 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 120.196 -1.565 . . . . 0.0 112.312 -179.435 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 152.23 -166.7 31.14 Favored Glycine 0 N--CA 1.47 0.901 0 C-N-CA 123.996 0.808 . . . . 0.0 113.298 -179.514 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.6 m -93.63 141.79 28.08 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.367 1.067 . . . . 0.0 110.467 -176.913 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -136.05 160.12 39.6 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.548 1.939 . . . . 0.0 110.972 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.7 pp -154.09 163.52 39.96 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 121.12 -0.988 . . . . 0.0 112.262 174.036 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 34.6 t -124.59 141.18 52.29 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.288 1.435 . . . . 0.0 110.494 -177.125 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -150.24 143.78 11.11 Favored Glycine 0 N--CA 1.47 0.96 0 N-CA-C 114.938 0.735 . . . . 0.0 114.938 -175.854 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -115.86 154.3 29.96 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.009 1.324 . . . . 0.0 113.04 -177.668 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 17.2 tt -146.64 133.29 13.85 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 125.344 1.458 . . . . 0.0 110.469 176.273 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 31.7 p -71.47 161.55 30.85 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.124 0.97 . . . . 0.0 113.427 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 47.3 mt -75.22 -3.42 32.98 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 114.233 1.197 . . . . 0.0 114.233 -179.047 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -67.8 151.69 96.97 Favored Pre-proline 0 CA--C 1.551 0.986 0 C-N-CA 124.729 1.212 . . . . 0.0 112.612 178.193 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -69.29 -23.9 32.43 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 122.939 2.426 . . . . 0.0 112.693 175.908 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 57.2 mtmt -92.39 10.28 30.61 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.247 1.419 . . . . 0.0 113.591 178.566 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -64.23 161.62 16.18 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.815 1.246 . . . . 0.0 114.014 -175.411 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 25.9 tt0 -147.07 149.02 32.26 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.02 1.728 . . . . 0.0 109.105 179.037 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 58.1 mt -77.21 123.93 34.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 123.181 0.592 . . . . 0.0 110.967 -176.331 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -93.99 137.84 32.76 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.506 1.522 . . . . 0.0 108.709 168.19 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -120.06 142.41 48.88 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.098 0.959 . . . . 0.0 111.797 -175.29 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 23.7 m -89.65 167.13 13.16 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.192 0.997 . . . . 0.0 112.251 169.56 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.4 139.38 58.21 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.12 0.968 . . . . 0.0 110.665 176.202 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.57 151.88 44.55 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -172.838 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.87 161.12 19.25 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.062 1.745 . . . . 0.0 111.347 174.665 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -120.95 135.46 55.2 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.036 1.334 . . . . 0.0 110.016 176.906 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 46.3 tp -107.79 128.82 54.93 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 125.622 1.569 . . . . 0.0 109.724 173.498 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 4.5 tpm_? -123.83 113.14 18.14 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.122 1.769 . . . . 0.0 109.203 177.97 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 16.3 t -106.85 114.48 46.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 123.628 0.771 . . . . 0.0 109.799 176.652 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 70.2 p -95.25 159.27 15.09 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.43 1.892 . . . . 0.0 111.593 -176.665 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -67.57 141.48 56.8 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.433 0.693 . . . . 0.0 112.168 -178.184 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 68.9 ttp85 . . . . . 0 N--CA 1.466 0.338 0 C-N-CA 124.419 1.088 . . . . 0.0 110.113 178.199 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 13.7 t . . . . . 0 N--CA 1.467 0.401 0 CA-C-O 121.433 0.635 . . . . 0.0 112.023 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -143.92 113.88 7.27 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 127.535 2.334 . . . . 0.0 107.982 178.332 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 95.1 p -140.83 159.61 61.71 Favored Pre-proline 0 CA--C 1.55 0.951 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 -168.662 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.22 161.72 84.06 Favored 'Cis proline' 0 C--N 1.355 0.916 0 CA-C-N 119.419 0.828 . . . . 0.0 111.598 -6.73 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.43 -27.86 69.29 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 175.062 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 tt -132.57 115.36 15.36 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 126.453 1.901 . . . . 0.0 108.71 173.847 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.7 tp -107.15 121.18 43.99 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.933 0.893 . . . . 0.0 109.63 172.092 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.0 t -106.38 125.54 62.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 124.132 0.973 . . . . 0.0 108.661 172.737 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.9 m -129.42 166.67 26.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 124.363 1.065 . . . . 0.0 111.422 169.804 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 73.6 m -88.76 150.33 23.0 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.26 1.024 . . . . 0.0 110.344 170.424 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -53.81 116.9 2.77 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.551 1.541 . . . . 0.0 111.313 173.335 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 89.67 8.31 67.82 Favored Glycine 0 CA--C 1.534 1.247 0 CA-C-O 118.547 -1.141 . . . . 0.0 114.62 -176.295 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -99.5 155.34 17.62 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 119.408 1.604 . . . . 0.0 111.96 171.484 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -78.5 119.56 21.96 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.99 0.916 . . . . 0.0 110.969 179.895 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -98.91 126.72 44.66 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.685 1.194 . . . . 0.0 110.749 175.941 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 97.7 m -132.78 125.6 30.49 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.774 0.83 . . . . 0.0 111.61 179.74 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -100.05 154.16 18.64 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.837 1.655 . . . . 0.0 109.441 168.191 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.3 m -106.52 134.26 49.93 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.689 1.195 . . . . 0.0 109.369 173.493 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 43.2 t -126.39 139.63 53.12 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.637 1.575 . . . . 0.0 111.959 176.156 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 99.2 p -151.23 153.38 34.79 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 121.437 -0.79 . . . . 0.0 112.132 170.594 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 . . . . . 0 CA--C 1.533 0.311 0 C-N-CA 125.787 1.635 . . . . 0.0 113.336 -174.778 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 35.6 p90 . . . . . 0 CA--C 1.538 0.489 0 CA-C-O 120.698 0.285 . . . . 0.0 110.784 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 79.2 t -95.87 123.14 47.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 170.091 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 22.3 tp -100.06 136.12 40.45 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.908 0.883 . . . . 0.0 109.776 176.564 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -130.71 154.69 47.68 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.689 1.596 . . . . 0.0 111.003 -169.746 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 19.3 t90 -130.9 137.68 49.43 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.755 1.222 . . . . 0.0 111.689 -177.351 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -136.15 146.43 46.89 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.53 1.132 . . . . 0.0 112.998 -173.058 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.6 ttt180 -103.71 140.88 37.0 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.962 1.305 . . . . 0.0 108.48 167.823 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 28.5 mtp -87.08 140.75 29.24 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.4 0.68 . . . . 0.0 111.931 176.719 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 48.6 m -91.94 157.62 40.98 Favored Pre-proline 0 CA--C 1.549 0.913 0 C-N-CA 124.714 1.206 . . . . 0.0 111.91 176.514 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -55.62 -34.01 88.85 Favored 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 123.957 3.104 . . . . 0.0 114.09 176.485 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.6 m -76.92 9.63 2.8 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.063 1.345 . . . . 0.0 113.855 176.935 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 26.5 m120 70.5 20.9 5.74 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 127.329 2.252 . . . . 0.0 113.386 -178.971 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -90.1 -172.67 3.57 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.555 1.142 . . . . 0.0 110.582 170.432 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.1 p -145.13 147.35 32.4 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.768 1.627 . . . . 0.0 110.488 -175.512 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -123.9 133.3 53.77 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 124.731 1.212 . . . . 0.0 111.235 174.16 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -79.92 118.8 22.0 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.916 0.886 . . . . 0.0 111.21 -178.03 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 61.8 mt -89.25 -53.75 4.42 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 125.002 1.321 . . . . 0.0 111.172 -173.709 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -165.4 172.15 12.55 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.854 1.662 . . . . 0.0 110.552 -174.797 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.59 167.81 27.6 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.27 1.428 . . . . 0.0 111.628 -178.094 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -156.22 135.08 7.67 Favored Pre-proline 0 CA--C 1.551 1.011 0 C-N-CA 123.998 0.919 . . . . 0.0 112.974 170.239 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo . . . . . 0 C--N 1.354 0.817 0 N-CA-C 108.98 -1.2 . . . . 0.0 108.98 -14.322 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 25.7 ptt-85 . . . . . 0 N--CA 1.471 0.581 0 N-CA-C 114.694 1.368 . . . . 0.0 114.694 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -91.02 117.74 29.82 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.47 1.108 . . . . 0.0 110.317 177.805 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -139.09 152.31 47.41 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.417 1.087 . . . . 0.0 112.343 -169.49 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 82.4 t -126.47 128.94 71.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 C-N-CA 125.841 1.656 . . . . 0.0 109.376 177.647 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 96.7 m -128.0 133.47 49.16 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.233 1.413 . . . . 0.0 110.332 -176.466 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -80.65 141.79 34.61 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.001 0.92 . . . . 0.0 112.136 176.608 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 27.2 mt -90.84 158.39 42.21 Favored Pre-proline 0 CA--C 1.545 0.764 0 C-N-CA 124.06 0.944 . . . . 0.0 111.456 172.172 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -65.23 -6.21 12.73 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.529 2.819 . . . . 0.0 114.18 174.623 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -63.0 -26.0 68.65 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 119.527 1.058 . . . . 0.0 112.66 169.436 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 98.69 -34.16 5.53 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 126.231 1.872 . . . . 0.0 114.379 172.611 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 40.6 mtm180 -136.22 73.65 1.47 Allowed 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 118.654 1.227 . . . . 0.0 109.837 170.41 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -168.81 139.83 2.49 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 128.254 2.622 . . . . 0.0 107.397 -176.861 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -143.44 149.85 38.19 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 114.457 1.28 . . . . 0.0 114.457 -167.92 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -102.08 128.67 48.45 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.622 1.569 . . . . 0.0 110.45 168.286 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -106.49 113.11 26.43 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 127.039 2.136 . . . . 0.0 108.071 176.11 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 52.9 m -121.88 132.42 54.56 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 114.817 1.414 . . . . 0.0 114.817 -167.763 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 21.9 t -102.04 104.43 16.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 167.469 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 88.1 t -69.59 126.99 30.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 123.725 0.81 . . . . 0.0 109.858 179.124 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 47.17 59.28 4.15 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.878 1.671 . . . . 0.0 112.327 177.854 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -59.92 137.7 58.01 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.049 1.34 . . . . 0.0 112.737 -170.018 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 36.5 mtp180 -100.01 158.49 15.79 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.914 1.685 . . . . 0.0 109.889 -176.91 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 20.1 mtp180 -58.92 -29.08 66.82 Favored 'General case' 0 N--CA 1.484 1.236 0 O-C-N 120.846 -1.159 . . . . 0.0 112.576 176.039 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -51.23 -30.53 17.72 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.534 1.934 . . . . 0.0 113.948 168.559 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 47.4 m-20 -90.3 -8.89 49.74 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.893 1.277 . . . . 0.0 113.119 -169.693 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 50.4 m -62.98 138.88 58.69 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.058 -1.026 . . . . 0.0 112.202 177.302 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 149.72 -170.15 29.87 Favored Glycine 0 N--CA 1.472 1.095 0 C-N-CA 124.669 1.128 . . . . 0.0 113.0 -177.029 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.6 m -89.34 140.98 28.96 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.136 0.974 . . . . 0.0 110.698 -177.517 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -132.15 160.98 34.46 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.949 2.1 . . . . 0.0 110.478 176.702 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -156.64 161.57 39.89 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.676 1.19 . . . . 0.0 112.33 175.496 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 23.6 t -113.81 151.36 32.17 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.685 1.594 . . . . 0.0 111.093 -178.006 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -152.57 136.8 5.56 Favored Glycine 0 N--CA 1.473 1.165 0 C-N-CA 124.082 0.848 . . . . 0.0 113.688 -179.529 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -111.33 153.81 25.44 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 118.352 1.076 . . . . 0.0 112.659 -179.22 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.8 tt -141.19 132.56 28.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.664 1.186 . . . . 0.0 110.44 170.414 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 29.6 t -65.22 161.57 19.04 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.805 1.242 . . . . 0.0 113.85 -175.216 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 3.1 pp -64.38 -12.65 44.83 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.445 1.498 . . . . 0.0 114.971 176.654 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -78.42 141.11 60.88 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 124.401 1.081 . . . . 0.0 112.398 -178.514 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_exo -56.59 -28.78 76.26 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.409 2.739 . . . . 0.0 114.319 173.203 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -81.92 -1.52 48.17 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.259 1.424 . . . . 0.0 113.861 -178.947 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.03 164.65 12.42 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 114.387 1.254 . . . . 0.0 114.387 -174.478 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -145.03 154.78 42.88 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.419 1.888 . . . . 0.0 108.81 176.466 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 55.8 mt -72.86 121.63 23.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 123.62 0.768 . . . . 0.0 111.328 -173.887 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -92.72 123.61 36.12 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.084 1.754 . . . . 0.0 108.944 169.071 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -87.31 145.2 26.44 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.818 0.847 . . . . 0.0 111.96 -179.005 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 5.2 t -92.77 -165.45 1.34 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.055 1.342 . . . . 0.0 112.002 170.065 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 87.3 mt -68.2 158.94 32.13 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.015 1.326 . . . . 0.0 111.206 169.895 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.29 147.46 31.42 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.76 1.224 . . . . 0.0 111.209 170.14 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -144.3 155.77 43.97 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.588 1.555 . . . . 0.0 111.342 -177.734 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -102.87 141.39 35.75 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 178.582 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 54.7 tp -99.6 131.75 45.39 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 126.836 2.054 . . . . 0.0 108.662 168.956 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 28.7 ttm180 -127.28 110.84 13.25 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.703 1.601 . . . . 0.0 109.429 -179.989 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 42.6 t -101.37 116.47 45.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 124.501 1.12 . . . . 0.0 108.84 177.519 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 72.8 p -98.1 147.79 24.2 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.628 1.571 . . . . 0.0 110.652 -178.635 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -59.53 139.81 56.82 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.267 0.627 . . . . 0.0 111.76 -177.824 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 79.1 ttt-85 . . . . . 0 C--O 1.236 0.353 0 C-N-CA 123.794 0.837 . . . . 0.0 110.311 -178.397 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.7 t . . . . . 0 N--CA 1.472 0.67 0 CA-C-O 120.993 0.425 . . . . 0.0 111.576 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -161.85 111.99 1.59 Allowed 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 126.034 1.734 . . . . 0.0 109.873 177.584 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 90.0 p -141.03 161.55 53.06 Favored Pre-proline 0 CA--C 1.549 0.918 0 C-N-CA 124.618 1.167 . . . . 0.0 114.097 -174.643 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -75.71 162.83 91.61 Favored 'Cis proline' 0 C--N 1.352 0.746 0 CA-C-N 118.952 0.662 . . . . 0.0 111.456 -10.073 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.69 -25.88 67.52 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 171.868 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 40.4 tp -140.51 118.83 12.1 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 125.907 1.683 . . . . 0.0 109.012 170.688 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 50.6 tp -103.56 129.64 50.83 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.817 1.247 . . . . 0.0 109.127 169.971 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 14.0 p -112.78 128.99 69.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 123.931 0.892 . . . . 0.0 110.271 170.05 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 27.5 m -128.47 166.43 25.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 125.47 1.508 . . . . 0.0 111.865 172.911 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.6 m -90.98 148.43 22.42 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.828 1.251 . . . . 0.0 110.38 173.511 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -54.24 122.03 9.45 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.395 1.478 . . . . 0.0 111.533 176.906 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.73 -1.44 78.47 Favored Glycine 0 CA--C 1.535 1.303 0 C-N-CA 125.585 1.564 . . . . 0.0 114.897 -176.972 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -88.94 159.41 17.66 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.439 1.62 . . . . 0.0 111.381 171.748 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -87.84 135.06 33.55 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.533 -0.729 . . . . 0.0 111.474 171.476 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -108.02 129.91 55.1 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.909 1.683 . . . . 0.0 110.534 179.346 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 39.5 m -132.88 130.22 39.42 Favored 'General case' 0 N--CA 1.476 0.866 0 CA-C-N 119.256 0.935 . . . . 0.0 112.032 178.908 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -102.03 157.66 16.71 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.798 2.039 . . . . 0.0 110.894 172.259 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 46.8 m -113.02 139.75 48.41 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 125.994 1.718 . . . . 0.0 110.058 178.571 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 53.6 t -150.34 149.36 29.98 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.068 1.347 . . . . 0.0 113.08 -177.608 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 8.1 t -154.1 161.76 41.67 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.597 1.159 . . . . 0.0 112.56 169.38 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 . . . . . 0 N--CA 1.47 0.561 0 C-N-CA 126.946 2.098 . . . . 0.0 112.228 -178.314 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 54.6 p90 . . . . . 0 CA--C 1.537 0.46 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.1 t -106.87 136.57 41.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 126.1 1.76 . . . . 0.0 106.917 167.689 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.6 tt -109.64 134.94 51.36 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.509 0.723 . . . . 0.0 109.777 174.845 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.442 HD21 HG22 ' A' ' 126' ' ' ILE . 2.4 m-80 -133.35 160.92 35.92 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -166.14 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 67.2 t-105 -115.54 131.65 56.87 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 126.532 1.933 . . . . 0.0 110.877 169.593 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -122.53 156.29 34.48 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.052 1.341 . . . . 0.0 111.956 179.298 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 43.6 ttt-85 -112.84 142.84 45.03 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 126.06 1.744 . . . . 0.0 109.871 169.451 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 67.2 mmm -75.78 142.52 42.3 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.84 0.856 . . . . 0.0 112.384 173.843 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.7 p -90.76 163.61 29.41 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 124.585 1.154 . . . . 0.0 111.101 168.698 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -69.66 -11.09 30.23 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 122.903 2.402 . . . . 0.0 113.086 173.204 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.0 t -94.78 8.09 43.74 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.879 1.272 . . . . 0.0 112.401 172.883 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 64.2 t30 68.84 21.89 7.46 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.744 2.018 . . . . 0.0 113.096 -178.635 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -93.19 -175.05 3.72 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.286 1.034 . . . . 0.0 109.502 169.382 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 11.9 p -138.94 150.41 45.88 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.278 1.031 . . . . 0.0 112.004 -172.859 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -133.96 133.8 41.79 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.081 0.953 . . . . 0.0 111.816 173.403 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -77.3 127.91 33.41 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.735 0.814 . . . . 0.0 111.502 -178.019 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 18.9 mt -106.56 -32.07 8.22 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.901 0.881 . . . . 0.0 113.296 178.65 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -154.57 161.45 41.61 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.303 1.441 . . . . 0.0 111.87 -177.056 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.57 166.31 31.05 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.503 1.121 . . . . 0.0 113.23 -179.133 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -144.24 114.28 5.31 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 126.544 1.937 . . . . 0.0 109.597 174.619 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo . . . . . 0 CA--C 1.538 0.707 0 CA-C-N 119.546 0.874 . . . . 0.0 112.761 -11.128 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 36.3 mtp-105 . . . . . 0 N--CA 1.47 0.525 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -85.21 139.32 31.75 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.444 1.098 . . . . 0.0 109.808 171.935 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 83.2 mtm180 -144.44 149.36 35.9 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.25 1.42 . . . . 0.0 111.605 -173.568 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 77.8 t -126.54 130.93 71.76 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 125.377 1.471 . . . . 0.0 108.409 168.988 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 58.7 m -128.82 138.76 52.24 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.871 1.268 . . . . 0.0 110.59 -174.85 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 27.0 tt0 -97.86 136.62 37.9 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.689 1.195 . . . . 0.0 110.215 170.898 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -97.36 159.87 30.19 Favored Pre-proline 0 CA--C 1.546 0.812 0 C-N-CA 125.427 1.491 . . . . 0.0 111.489 -170.431 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -66.68 -11.1 30.5 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 123.593 2.862 . . . . 0.0 114.056 -178.405 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 22.2 m120 -66.29 -19.33 65.79 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 119.087 0.858 . . . . 0.0 113.052 170.548 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 91.16 -33.87 4.53 Favored Glycine 0 N--CA 1.474 1.229 0 C-N-CA 126.391 1.948 . . . . 0.0 114.377 169.934 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 95.4 mtm-85 -129.06 73.72 1.53 Allowed 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.718 1.607 . . . . 0.0 108.659 169.594 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -170.15 141.6 2.13 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 127.341 2.257 . . . . 0.0 109.278 -178.787 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -145.46 150.36 36.34 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.624 0.726 . . . . 0.0 112.613 -169.725 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -118.98 149.49 41.53 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.421 1.488 . . . . 0.0 111.373 171.321 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.5 mpt? -128.4 124.93 37.54 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.191 0.996 . . . . 0.0 109.358 171.37 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.1 t -124.6 148.29 47.96 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -168.817 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 17.0 t -125.09 105.94 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 127.128 2.171 . . . . 0.0 107.817 176.001 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 96.1 t -80.06 131.43 34.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 124.362 1.065 . . . . 0.0 111.152 -174.997 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 48.8 ttt85 53.4 61.3 3.2 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.917 1.687 . . . . 0.0 111.278 176.002 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.4 129.31 39.56 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.426 1.091 . . . . 0.0 110.844 -172.964 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 12.7 mmt-85 -100.6 167.99 9.99 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.765 1.626 . . . . 0.0 109.511 174.464 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 90.9 mtm-85 -55.56 -34.47 64.78 Favored 'General case' 0 N--CA 1.479 1.015 0 O-C-N 120.922 -1.111 . . . . 0.0 113.009 -178.877 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 34.5 t30 -62.1 -23.79 66.74 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.395 1.478 . . . . 0.0 114.514 174.87 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -80.36 -5.72 56.86 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.087 0.955 . . . . 0.0 112.82 176.258 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 24.4 m -65.49 136.43 56.42 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 120.405 -1.434 . . . . 0.0 110.99 169.943 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 160.07 -165.44 34.76 Favored Glycine 0 N--CA 1.467 0.732 0 O-C-N 121.558 -0.714 . . . . 0.0 113.241 -177.267 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.1 m -107.87 132.22 53.68 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.088 0.955 . . . . 0.0 110.338 -175.933 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -140.71 168.11 20.58 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.661 1.585 . . . . 0.0 111.759 -174.123 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -159.99 151.02 19.25 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 115.013 1.486 . . . . 0.0 115.013 -177.034 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 46.4 t -88.77 136.96 32.73 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.964 2.106 . . . . 0.0 111.275 173.814 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -159.02 135.19 4.08 Favored Glycine 0 N--CA 1.475 1.249 0 N-CA-C 115.402 0.921 . . . . 0.0 115.402 174.859 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -99.0 159.21 15.12 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.34 1.456 . . . . 0.0 112.501 176.393 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.442 HG22 HD21 ' A' ' 66' ' ' ASN . 19.0 tt -150.97 134.78 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 125.245 1.418 . . . . 0.0 110.749 178.539 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 41.7 t -64.69 159.66 21.65 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.057 0.943 . . . . 0.0 113.105 177.279 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 44.1 mt -75.51 -12.15 60.17 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.298 0.851 . . . . 0.0 113.298 172.324 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -65.14 147.01 98.84 Favored Pre-proline 0 CA--C 1.552 1.03 0 C-N-CA 124.036 0.934 . . . . 0.0 112.775 -179.432 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -56.5 -30.32 81.91 Favored 'Trans proline' 0 C--N 1.354 0.836 0 C-N-CA 123.511 2.807 . . . . 0.0 114.208 174.142 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 60.2 mtpt -88.35 5.98 39.43 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.193 1.397 . . . . 0.0 113.975 -178.197 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -61.18 153.31 26.33 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 -173.617 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -137.06 159.05 43.04 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.396 1.878 . . . . 0.0 108.744 174.365 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 45.2 mt -78.82 123.7 36.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 O-C-N 121.72 -0.613 . . . . 0.0 110.572 -175.939 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -97.03 104.06 16.04 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 126.106 1.762 . . . . 0.0 108.251 169.065 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -123.06 158.81 29.78 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.994 1.318 . . . . 0.0 113.868 -169.056 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 53.3 m -97.92 159.08 15.16 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.373 1.069 . . . . 0.0 112.14 171.748 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 10.6 mp -63.7 130.39 44.03 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.951 0.9 . . . . 0.0 110.953 -177.674 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.21 145.69 36.4 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.85 1.426 . . . . 0.0 114.85 -170.046 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -125.91 162.89 24.16 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.739 2.015 . . . . 0.0 112.067 -176.259 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -106.31 141.48 37.57 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.938 1.295 . . . . 0.0 112.375 -172.406 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 52.5 tp -115.41 131.58 56.89 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 126.332 1.853 . . . . 0.0 109.114 169.656 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 62.3 ttm-85 -124.07 123.48 40.42 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.794 1.638 . . . . 0.0 110.367 177.638 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 40.0 t -107.8 114.02 45.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 125.037 1.335 . . . . 0.0 109.272 172.676 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 73.0 p -95.11 152.2 18.55 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.509 1.524 . . . . 0.0 110.705 178.142 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -60.02 144.54 49.08 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.617 0.767 . . . . 0.0 112.679 -176.698 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 31.7 tpt85 . . . . . 0 C--O 1.235 0.312 0 C-N-CA 124.269 1.028 . . . . 0.0 109.239 175.624 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.9 t . . . . . 0 N--CA 1.481 1.123 0 CA-C-O 120.317 0.103 . . . . 0.0 111.211 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -125.03 133.64 52.87 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.803 1.641 . . . . 0.0 110.121 -178.538 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 93.6 p -140.96 155.19 68.95 Favored Pre-proline 0 CA--C 1.551 0.981 0 N-CA-C 114.511 1.3 . . . . 0.0 114.511 -176.756 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -68.96 162.03 82.66 Favored 'Cis proline' 0 C--N 1.353 0.766 0 CA-C-N 119.101 0.715 . . . . 0.0 111.511 -7.422 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.33 -32.61 70.24 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 122.803 0.441 . . . . 0.0 112.169 173.119 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 50.1 tp -140.23 120.41 13.81 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 125.452 1.501 . . . . 0.0 109.294 171.175 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 55.8 tp -100.6 125.89 47.02 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.439 1.496 . . . . 0.0 109.003 170.104 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.8 t -108.82 125.64 65.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 171.203 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 27.7 m -128.69 163.4 33.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 124.775 1.23 . . . . 0.0 110.83 173.014 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 52.7 m -88.21 146.95 25.1 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.592 0.757 . . . . 0.0 110.097 169.911 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -54.36 123.04 11.73 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.289 1.436 . . . . 0.0 111.074 174.822 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.08 3.52 72.97 Favored Glycine 0 CA--C 1.532 1.111 0 C-N-CA 125.863 1.697 . . . . 0.0 114.9 -174.733 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -90.26 157.02 17.88 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 119.612 1.706 . . . . 0.0 111.376 169.214 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -85.49 119.77 26.21 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.763 0.825 . . . . 0.0 109.957 174.628 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -98.84 129.62 45.23 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.466 1.107 . . . . 0.0 110.752 -179.246 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 89.9 m -132.73 131.46 41.24 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 119.352 0.978 . . . . 0.0 111.692 177.392 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -102.93 155.93 18.02 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.381 1.873 . . . . 0.0 111.089 172.52 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.6 m -98.68 136.03 39.32 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 125.402 1.481 . . . . 0.0 107.887 168.874 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 35.7 t -138.1 124.68 20.83 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 124.639 1.176 . . . . 0.0 110.308 -179.704 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 75.6 m -116.14 143.89 44.88 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 124.228 1.011 . . . . 0.0 111.094 -173.219 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 . . . . . 0 N--CA 1.465 0.288 0 C-N-CA 125.185 1.394 . . . . 0.0 113.694 170.026 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 53.9 p90 . . . . . 0 CA--C 1.538 0.514 0 CA-C-O 120.946 0.403 . . . . 0.0 111.946 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.6 t -95.98 128.24 47.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 171.466 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -112.77 118.67 35.61 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 125.379 1.471 . . . . 0.0 108.687 -177.123 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -116.48 155.24 28.96 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.921 1.688 . . . . 0.0 111.636 -169.438 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 13.6 t90 -124.32 138.57 54.37 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.726 1.211 . . . . 0.0 112.29 179.941 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 53.7 m-85 -136.65 145.61 45.01 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.031 1.333 . . . . 0.0 113.528 -174.973 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 78.9 ttt-85 -106.42 142.0 36.8 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.683 1.593 . . . . 0.0 108.414 167.833 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 37.1 mtp -86.73 145.37 26.69 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 119.034 0.833 . . . . 0.0 112.624 177.864 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.6 m -92.41 159.13 37.57 Favored Pre-proline 0 CA--C 1.547 0.86 0 C-N-CA 125.056 1.342 . . . . 0.0 111.999 175.755 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -57.79 -25.73 70.23 Favored 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 124.102 3.201 . . . . 0.0 114.224 174.412 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 33.5 p -77.06 -0.56 25.11 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.474 1.91 . . . . 0.0 114.017 174.943 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 71.16 20.87 4.99 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 127.178 2.191 . . . . 0.0 112.442 -173.111 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 20.5 mm100 -88.3 -172.67 3.88 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.033 0.933 . . . . 0.0 110.083 168.99 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.7 p -141.35 150.1 42.0 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.761 1.624 . . . . 0.0 110.628 -175.817 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -128.15 132.26 48.91 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.786 1.234 . . . . 0.0 111.032 176.909 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 57.0 tttt -79.76 132.47 36.17 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.372 0.669 . . . . 0.0 111.644 -176.639 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 67.9 mt -106.88 -46.09 4.03 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.077 1.351 . . . . 0.0 112.487 -169.921 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -174.15 175.95 2.61 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 127.175 2.19 . . . . 0.0 110.089 -174.478 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.63 167.7 27.83 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.888 1.275 . . . . 0.0 112.318 -179.363 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.461 ' CG ' ' HA ' ' A' ' 83' ' ' PRO . 54.7 t80 -129.33 144.0 51.06 Favored Pre-proline 0 CA--C 1.549 0.909 0 C-N-CA 126.181 1.792 . . . . 0.0 110.226 169.808 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.461 ' HA ' ' CG ' ' A' ' 82' ' ' PHE . 68.4 Cg_exo . . . . . 0 C--N 1.356 0.969 0 N-CA-C 116.352 1.635 . . . . 0.0 116.352 2.755 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 46.5 mtp85 . . . . . 0 N--CA 1.471 0.582 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 -101.43 142.32 32.99 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.139 1.775 . . . . 0.0 112.013 -172.673 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 65.3 ttt180 -143.48 144.36 31.96 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.63 1.572 . . . . 0.0 111.27 178.475 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 57.6 t -120.34 132.56 69.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 125.663 1.585 . . . . 0.0 109.08 169.707 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 25.0 m -126.66 133.79 50.89 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.922 1.289 . . . . 0.0 109.858 177.11 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -84.86 138.38 32.58 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.398 0.679 . . . . 0.0 110.67 172.481 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 41.5 mt -85.07 159.61 56.65 Favored Pre-proline 0 CA--C 1.544 0.717 0 C-N-CA 124.863 1.265 . . . . 0.0 111.771 179.247 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -63.03 -5.91 8.61 Favored 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 123.675 2.917 . . . . 0.0 113.95 174.012 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 23.2 m120 -60.93 -25.22 66.62 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.191 0.996 . . . . 0.0 112.852 169.251 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 89.23 -16.51 55.67 Favored Glycine 0 N--CA 1.476 1.308 0 C-N-CA 125.53 1.538 . . . . 0.0 114.768 174.427 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.6 ptp180 -154.57 73.69 0.91 Allowed 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 126.198 1.799 . . . . 0.0 109.487 169.816 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -173.73 148.67 1.5 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 128.378 2.671 . . . . 0.0 108.55 -178.642 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -146.66 153.48 40.35 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.796 1.035 . . . . 0.0 113.796 -166.844 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -116.33 141.75 47.75 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.887 1.675 . . . . 0.0 110.065 168.115 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 42.5 mtt -130.73 115.29 16.45 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 124.629 1.172 . . . . 0.0 110.546 -173.924 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 43.7 m -116.02 134.03 55.39 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.36 1.245 . . . . 0.0 114.36 -167.749 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 17.1 t -104.56 113.72 42.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 126.569 1.948 . . . . 0.0 106.825 167.865 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 4.0 p -77.48 133.61 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 122.513 0.325 . . . . 0.0 110.755 -179.911 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 45.92 64.11 1.59 Allowed 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 125.491 1.516 . . . . 0.0 112.08 174.12 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.02 144.41 57.3 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.368 1.067 . . . . 0.0 112.994 -169.694 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 54.3 mtp85 -114.87 158.33 22.1 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 126.598 1.959 . . . . 0.0 110.036 -176.393 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 91.0 mtm-85 -53.6 -32.62 51.87 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 -178.833 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -70.84 -18.82 62.7 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 115.676 1.732 . . . . 0.0 115.676 176.613 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -73.2 -25.55 60.81 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 119.566 1.076 . . . . 0.0 112.045 178.769 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 14.8 m -51.35 139.44 19.32 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.979 1.312 . . . . 0.0 112.905 178.923 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 152.09 -166.6 31.04 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 124.338 0.971 . . . . 0.0 113.023 -175.777 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.5 m -92.36 143.88 25.94 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.9 1.28 . . . . 0.0 110.167 -179.617 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -138.39 156.55 47.49 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.931 1.692 . . . . 0.0 111.719 -177.606 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -163.06 157.09 20.34 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.06 1.344 . . . . 0.0 112.4 177.527 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 5.6 m -100.51 162.98 12.57 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.997 0.919 . . . . 0.0 111.85 172.724 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -145.21 130.19 3.76 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 124.392 0.996 . . . . 0.0 112.163 169.437 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -111.65 145.0 40.0 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 118.41 1.105 . . . . 0.0 112.327 178.437 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.4 tt -141.34 133.58 29.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.236 1.414 . . . . 0.0 110.125 179.405 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 53.2 p -71.48 161.62 30.74 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 -176.594 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -58.44 -15.49 11.09 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 115.372 1.619 . . . . 0.0 115.372 177.399 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -70.56 136.6 85.96 Favored Pre-proline 0 CA--C 1.552 1.027 0 C-N-CA 125.047 1.339 . . . . 0.0 112.244 -178.359 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_exo -57.07 -27.89 76.12 Favored 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 123.426 2.751 . . . . 0.0 114.066 172.631 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 14.5 tppt? -84.4 1.73 43.94 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 125.395 1.478 . . . . 0.0 113.997 -177.916 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -67.11 161.41 24.64 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -172.959 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 28.0 mp0 -128.09 159.15 35.99 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.794 2.037 . . . . 0.0 108.983 170.72 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 42.4 mt -82.83 120.44 34.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 123.509 0.723 . . . . 0.0 110.597 178.868 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 15.3 ptpt -90.99 143.76 26.38 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.421 1.089 . . . . 0.0 111.241 168.648 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -140.07 158.79 43.5 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 126.255 1.822 . . . . 0.0 110.351 -173.222 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 6.2 t -136.74 -166.67 1.94 Allowed 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.269 1.028 . . . . 0.0 112.871 -179.985 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 96.4 mt -62.7 124.77 21.86 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.268 1.827 . . . . 0.0 112.423 -170.371 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 73.6 mtm-85 -62.23 151.36 36.45 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.817 1.647 . . . . 0.0 113.507 -173.965 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.89 166.26 12.17 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.668 1.987 . . . . 0.0 110.846 173.33 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -133.85 146.24 50.42 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.422 1.089 . . . . 0.0 111.996 178.727 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 59.5 tp -113.86 137.11 52.12 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 126.182 1.793 . . . . 0.0 110.201 173.051 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 61.9 ttm-85 -127.81 120.18 27.28 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 125.522 1.529 . . . . 0.0 109.699 169.412 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 43.5 t -104.32 113.35 41.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 124.786 1.234 . . . . 0.0 108.742 173.144 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 53.8 p -95.05 140.88 29.38 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.349 1.459 . . . . 0.0 110.039 -178.697 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 4.2 pm0 -61.96 144.32 55.24 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.729 0.812 . . . . 0.0 112.855 -172.406 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 45.3 ttt85 . . . . . 0 N--CA 1.468 0.437 0 C-N-CA 124.049 0.939 . . . . 0.0 110.837 -170.399 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 86.7 m . . . . . 0 N--CA 1.472 0.648 0 CA-C-O 121.438 0.637 . . . . 0.0 110.944 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -114.11 124.32 51.8 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.97 2.108 . . . . 0.0 108.11 169.318 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 88.0 p -140.75 156.09 69.05 Favored Pre-proline 0 CA--C 1.549 0.916 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -169.156 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -66.68 161.18 75.84 Favored 'Cis proline' 0 C--N 1.355 0.894 0 CA-C-N 119.84 0.979 . . . . 0.0 112.111 -2.457 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.81 -27.5 66.65 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 177.75 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 49.1 tp -141.15 122.54 14.93 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.365 1.466 . . . . 0.0 108.749 169.835 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 59.5 tp -106.16 126.06 51.75 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.157 1.383 . . . . 0.0 109.057 170.869 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.3 t -109.68 124.43 66.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 123.864 0.866 . . . . 0.0 108.798 172.998 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 33.7 m -128.66 172.43 15.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 C-N-CA 124.919 1.287 . . . . 0.0 110.951 171.43 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 66.2 m -104.48 151.92 22.98 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.516 1.526 . . . . 0.0 110.313 170.971 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -44.29 124.63 4.12 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.313 1.445 . . . . 0.0 112.967 172.357 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 89.99 -2.37 81.68 Favored Glycine 0 CA--C 1.531 1.048 0 C-N-CA 125.732 1.634 . . . . 0.0 114.484 -179.261 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -89.31 153.82 20.58 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.699 1.75 . . . . 0.0 111.909 174.367 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -80.81 118.25 22.17 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.588 0.755 . . . . 0.0 110.355 174.806 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -97.32 114.26 26.02 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.074 0.95 . . . . 0.0 110.533 178.978 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 46.9 m -122.35 124.19 43.13 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.936 0.895 . . . . 0.0 111.4 -175.288 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -102.45 158.16 16.41 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 126.646 1.978 . . . . 0.0 110.742 171.683 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 86.1 m -101.63 135.05 43.8 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.13 1.372 . . . . 0.0 109.551 169.861 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 42.7 t -113.7 132.79 55.67 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.611 1.564 . . . . 0.0 110.691 169.631 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 67.3 m -126.55 122.13 34.24 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.948 0.899 . . . . 0.0 110.852 179.574 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 24.8 m-85 . . . . . 0 N--CA 1.47 0.528 0 C-N-CA 126.701 2.0 . . . . 0.0 110.682 169.515 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 52.1 p90 . . . . . 0 CA--C 1.54 0.566 0 CA-C-O 120.481 0.181 . . . . 0.0 110.774 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 58.2 t -95.94 129.35 46.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 C-N-CA 124.503 1.121 . . . . 0.0 108.24 175.29 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 19.4 tp -107.59 139.72 41.7 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.417 1.087 . . . . 0.0 109.923 172.592 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 13.6 m-80 -132.78 149.84 52.23 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.524 1.529 . . . . 0.0 111.107 -168.997 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 18.3 t90 -121.73 137.89 54.58 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.035 1.334 . . . . 0.0 111.617 -179.055 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -137.43 145.33 43.03 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 -172.836 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -102.03 139.76 37.22 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.021 1.328 . . . . 0.0 108.274 167.01 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 32.8 mtp -84.26 142.75 30.02 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.107 0.867 . . . . 0.0 112.11 176.862 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 45.6 m -91.17 158.4 41.41 Favored Pre-proline 0 CA--C 1.548 0.883 0 C-N-CA 124.843 1.257 . . . . 0.0 111.68 174.867 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -55.43 -33.45 85.89 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 123.947 3.098 . . . . 0.0 114.346 177.245 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.3 m -76.99 6.31 6.52 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.904 1.282 . . . . 0.0 113.895 177.374 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 74.02 20.93 2.69 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 127.208 2.203 . . . . 0.0 112.895 -178.188 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 20.7 mm100 -88.63 -172.89 3.92 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.185 0.994 . . . . 0.0 110.258 169.658 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.6 p -145.48 142.69 29.47 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.663 1.585 . . . . 0.0 110.323 -174.805 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -119.93 130.55 54.85 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 124.578 1.151 . . . . 0.0 111.17 175.493 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -77.97 125.75 29.81 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.364 1.065 . . . . 0.0 111.089 -177.12 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 55.7 mt -99.81 -49.31 4.4 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 125.172 1.389 . . . . 0.0 111.278 -172.658 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -162.6 173.16 14.3 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.249 1.819 . . . . 0.0 110.479 -178.006 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.18 163.34 36.11 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.074 1.35 . . . . 0.0 111.733 -178.215 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -145.62 124.08 6.52 Favored Pre-proline 0 CA--C 1.546 0.825 0 C-N-CA 124.833 1.253 . . . . 0.0 110.676 172.229 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo . . . . . 0 CA--C 1.538 0.681 0 CA-C-N 119.48 0.85 . . . . 0.0 112.761 -12.949 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 41.6 mmm-85 . . . . . 0 CA--C 1.536 0.433 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 -108.05 135.3 49.64 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.789 1.236 . . . . 0.0 111.046 177.82 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 49.7 ttp180 -138.11 136.95 37.23 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.679 1.591 . . . . 0.0 110.609 -176.242 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 87.3 t -126.43 130.25 71.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 C-N-CA 125.633 1.573 . . . . 0.0 109.157 175.579 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 87.1 m -130.58 130.34 43.92 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.117 1.367 . . . . 0.0 110.281 -176.363 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -82.87 133.97 35.11 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.16 0.984 . . . . 0.0 110.195 173.652 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 28.4 mt -86.63 160.33 50.67 Favored Pre-proline 0 CA--C 1.543 0.697 0 C-N-CA 123.587 0.755 . . . . 0.0 111.339 176.659 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -62.49 -8.23 12.44 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 123.374 2.716 . . . . 0.0 114.187 174.75 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -65.77 -22.34 66.57 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-N 119.207 0.912 . . . . 0.0 112.602 169.271 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 80.66 -34.33 2.3 Favored Glycine 0 N--CA 1.473 1.167 0 C-N-CA 128.232 2.825 . . . . 0.0 113.914 175.871 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? -122.62 73.64 1.14 Allowed 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.743 1.617 . . . . 0.0 108.663 168.191 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -177.64 140.82 0.27 Allowed 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 128.495 2.718 . . . . 0.0 108.432 176.651 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -143.64 153.26 42.33 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 -168.666 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 21.4 m170 -108.67 131.72 54.63 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.341 1.456 . . . . 0.0 110.845 168.556 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -113.95 120.25 40.03 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 126.612 1.965 . . . . 0.0 108.157 176.691 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.2 t -128.31 127.17 42.22 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -168.383 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 47.8 t -91.17 116.39 32.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 125.441 1.496 . . . . 0.0 107.08 169.117 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 61.0 t -83.96 120.26 34.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 124.637 1.175 . . . . 0.0 109.638 -175.784 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 52.15 65.73 1.42 Allowed 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.228 1.811 . . . . 0.0 111.567 179.167 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.66 147.59 51.65 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.717 1.207 . . . . 0.0 112.628 -171.507 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 54.7 mmm-85 -122.72 165.31 16.75 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.971 1.709 . . . . 0.0 110.578 178.475 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 34.9 mtp180 -55.11 -33.88 63.21 Favored 'General case' 0 N--CA 1.483 1.217 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 -173.15 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -62.12 -18.54 61.13 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 125.241 1.417 . . . . 0.0 114.637 175.28 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 -81.21 -12.65 59.11 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 119.582 1.083 . . . . 0.0 113.316 176.903 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 20.9 m -62.64 138.63 58.54 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 119.517 1.053 . . . . 0.0 112.438 -179.486 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 154.74 -166.93 32.53 Favored Glycine 0 N--CA 1.473 1.124 0 O-C-N 121.377 -0.827 . . . . 0.0 113.611 -177.033 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 6.4 m -93.9 144.35 25.52 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.334 1.054 . . . . 0.0 110.366 -178.844 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 68.9 m-85 -142.96 155.51 44.7 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.354 1.461 . . . . 0.0 111.681 -177.989 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.4 pp -153.5 173.43 15.71 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.37 1.068 . . . . 0.0 112.593 177.933 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 28.1 t -125.6 156.13 39.63 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.813 1.645 . . . . 0.0 110.316 -176.209 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -152.74 137.02 5.64 Favored Glycine 0 N--CA 1.47 0.931 0 O-C-N 121.197 -0.939 . . . . 0.0 114.677 -179.188 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -110.02 152.1 26.34 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.736 1.214 . . . . 0.0 112.721 -179.506 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.5 tt -152.13 135.44 7.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 125.55 1.54 . . . . 0.0 110.442 173.634 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 33.7 m -67.04 159.65 28.26 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.775 0.83 . . . . 0.0 112.91 179.452 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 2.3 pp -72.05 -7.93 51.68 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 115.406 1.632 . . . . 0.0 115.406 -176.861 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -80.8 148.59 65.46 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 124.71 1.204 . . . . 0.0 112.082 177.156 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -68.66 -19.79 41.37 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 123.245 2.63 . . . . 0.0 113.355 -179.924 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -77.37 -9.56 58.92 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.798 1.239 . . . . 0.0 113.665 177.12 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.86 162.85 20.77 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.004 1.322 . . . . 0.0 113.785 -175.765 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -138.21 154.72 49.1 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.011 1.724 . . . . 0.0 109.368 175.857 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 45.8 mt -79.27 126.66 39.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 123.345 0.658 . . . . 0.0 110.838 -175.687 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -102.6 129.09 49.06 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.223 1.409 . . . . 0.0 109.38 169.375 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -104.11 149.42 25.24 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.742 1.217 . . . . 0.0 111.842 -174.386 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 88.1 p -91.62 170.03 10.26 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.661 1.356 . . . . 0.0 114.661 178.81 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 87.8 mt -68.27 127.77 34.13 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.033 0.933 . . . . 0.0 109.471 168.809 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.1 166.88 20.47 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 115.236 1.569 . . . . 0.0 115.236 -169.602 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -126.35 168.78 13.69 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.842 2.057 . . . . 0.0 111.234 169.574 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -120.57 142.16 49.62 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.301 1.44 . . . . 0.0 110.89 173.007 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 51.4 tp -110.16 131.24 55.23 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 126.082 1.753 . . . . 0.0 109.791 171.852 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -121.78 117.66 27.11 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.674 1.59 . . . . 0.0 109.395 169.955 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 39.5 t -104.18 111.84 35.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 C-N-CA 124.225 1.01 . . . . 0.0 108.665 170.949 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 71.8 p -86.69 151.3 23.53 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 126.087 1.755 . . . . 0.0 110.28 179.564 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -63.09 149.29 45.52 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.811 0.844 . . . . 0.0 112.805 -175.142 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 56.8 ttp180 . . . . . 0 C--O 1.236 0.366 0 C-N-CA 124.517 1.127 . . . . 0.0 109.697 -174.21 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 37.3 p . . . . . 0 N--CA 1.479 0.975 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -121.93 134.39 54.84 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.382 1.473 . . . . 0.0 109.912 173.936 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.9 m -140.85 156.39 68.73 Favored Pre-proline 0 N--CA 1.479 1.016 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 179.523 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -70.17 158.16 92.51 Favored 'Cis proline' 0 C--N 1.352 0.733 0 CA-C-N 119.494 0.855 . . . . 0.0 110.926 -8.646 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -56.96 -32.01 65.6 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 172.715 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 49.2 tp -139.13 121.17 15.66 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.351 1.46 . . . . 0.0 109.322 170.031 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 49.4 tp -102.19 126.93 49.3 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.351 1.46 . . . . 0.0 109.205 171.019 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.6 t -110.75 124.64 67.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 124.081 0.952 . . . . 0.0 108.454 172.011 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 36.0 m -127.52 168.83 19.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 124.618 1.167 . . . . 0.0 111.677 174.174 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 44.0 m -94.54 146.41 24.12 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.869 1.267 . . . . 0.0 110.151 170.915 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -57.13 117.65 4.24 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.474 1.51 . . . . 0.0 111.867 -178.973 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 100.26 -2.9 56.53 Favored Glycine 0 CA--C 1.534 1.268 0 C-N-CA 125.919 1.723 . . . . 0.0 114.58 -175.937 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -86.21 157.27 20.01 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.232 1.516 . . . . 0.0 112.286 173.988 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -83.25 113.48 20.71 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.006 0.923 . . . . 0.0 110.44 175.773 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -95.82 116.63 29.19 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.101 0.961 . . . . 0.0 110.837 -178.754 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 36.1 m -121.5 127.49 51.09 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.763 0.825 . . . . 0.0 111.558 -177.014 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -100.66 150.42 22.75 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.07 1.748 . . . . 0.0 110.896 170.625 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 27.3 m -93.15 137.88 32.08 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 125.917 1.687 . . . . 0.0 108.179 169.337 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 42.9 t -143.88 131.19 20.85 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.9 1.28 . . . . 0.0 110.37 -176.356 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.9 t -128.27 136.09 50.54 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 121.321 -0.862 . . . . 0.0 112.058 -169.663 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 . . . . . 0 CA--C 1.535 0.382 0 C-N-CA 125.786 1.634 . . . . 0.0 113.464 174.504 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 54.4 p90 . . . . . 0 CA--C 1.538 0.499 0 CA-C-O 120.947 0.403 . . . . 0.0 111.787 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.4 t -95.95 129.39 46.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 125.204 1.402 . . . . 0.0 107.275 172.927 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 57.8 tp -99.39 134.72 41.85 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 124.167 0.987 . . . . 0.0 109.528 173.984 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 -127.84 155.39 44.2 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.107 1.363 . . . . 0.0 110.641 -177.922 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 10.1 t90 -125.36 137.3 54.03 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.634 1.174 . . . . 0.0 111.628 178.868 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -132.81 150.93 52.11 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.228 1.411 . . . . 0.0 113.347 -176.392 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -112.73 141.5 46.45 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.794 1.638 . . . . 0.0 109.178 168.992 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 81.2 mmm -74.19 133.39 42.73 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.057 0.543 . . . . 0.0 111.34 173.755 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 50.0 m -86.04 157.52 56.85 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 124.65 1.18 . . . . 0.0 111.783 172.807 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -57.57 -28.25 80.34 Favored 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 123.905 3.07 . . . . 0.0 114.284 174.97 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 25.2 p -77.03 3.81 11.51 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 126.022 1.729 . . . . 0.0 114.033 174.868 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 67.53 20.96 9.65 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 127.308 2.243 . . . . 0.0 112.932 -174.021 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -90.13 -172.65 3.56 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.958 1.303 . . . . 0.0 109.925 169.045 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.0 p -138.98 145.65 39.97 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.025 1.33 . . . . 0.0 110.347 -177.717 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -122.67 134.56 54.48 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 123.775 0.83 . . . . 0.0 111.569 173.154 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -75.23 137.52 41.3 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.96 0.904 . . . . 0.0 111.174 179.406 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 52.0 mt -114.55 -39.78 3.73 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.384 1.474 . . . . 0.0 112.865 -169.916 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -171.7 175.29 4.03 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.619 1.968 . . . . 0.0 110.175 -176.126 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -157.06 167.72 29.61 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.936 1.294 . . . . 0.0 112.096 179.844 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -145.23 115.44 4.99 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 125.76 1.624 . . . . 0.0 109.378 169.345 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_exo . . . . . 0 C--N 1.352 0.713 0 CA-C-N 120.22 1.114 . . . . 0.0 113.546 -5.573 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 30.4 ptt-85 . . . . . 0 CA--C 1.536 0.425 0 N-CA-C 113.893 1.072 . . . . 0.0 113.893 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 84.6 m-85 -93.83 123.41 37.16 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.488 1.115 . . . . 0.0 110.013 176.078 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -139.02 144.68 38.98 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.146 0.978 . . . . 0.0 111.645 -175.267 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 57.5 t -126.55 126.73 69.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 125.36 1.464 . . . . 0.0 109.379 -179.428 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 86.4 m -130.53 137.75 49.87 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.876 1.271 . . . . 0.0 110.421 -176.109 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -82.17 141.93 32.63 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.358 0.599 . . . . 0.0 112.459 172.249 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 39.2 mt -77.9 161.05 72.67 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 123.419 0.687 . . . . 0.0 110.898 169.37 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -68.37 -4.16 12.32 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 123.435 2.757 . . . . 0.0 113.562 171.699 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.81 -23.05 65.98 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 124.33 1.052 . . . . 0.0 112.494 172.005 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 93.66 -18.43 56.52 Favored Glycine 0 N--CA 1.477 1.428 0 C-N-CA 125.646 1.593 . . . . 0.0 114.715 170.695 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 27.1 ptt180 -154.59 73.66 0.91 Allowed 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 126.085 1.754 . . . . 0.0 109.204 170.08 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -173.8 147.53 1.36 Allowed 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 128.308 2.643 . . . . 0.0 108.462 -178.461 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 25.0 m-85 -146.86 157.08 43.56 Favored 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 113.958 1.096 . . . . 0.0 113.958 -166.383 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -116.55 143.09 46.04 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.193 1.797 . . . . 0.0 110.744 169.014 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 39.8 mtt -126.85 120.64 29.74 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.975 1.31 . . . . 0.0 109.95 177.615 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 69.0 m -120.42 128.21 52.98 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 114.263 1.208 . . . . 0.0 114.263 -168.041 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 21.6 t -94.6 98.88 8.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 N-CA-C 105.958 -1.868 . . . . 0.0 105.958 167.017 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 92.8 t -70.5 125.43 28.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.597 1.159 . . . . 0.0 109.182 -179.035 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 75.8 ttt180 52.35 65.59 1.46 Allowed 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.21 1.404 . . . . 0.0 110.929 179.181 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.26 130.57 43.29 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 121.327 -0.858 . . . . 0.0 111.721 -172.281 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 8.1 mpt_? -95.3 161.83 13.93 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.594 1.558 . . . . 0.0 110.086 175.266 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 89.8 mtm-85 -53.4 -36.92 61.98 Favored 'General case' 0 N--CA 1.482 1.141 0 O-C-N 121.151 -0.968 . . . . 0.0 112.708 179.732 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -62.35 -16.03 51.94 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.045 1.738 . . . . 0.0 114.845 176.264 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -80.53 -11.16 59.7 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 119.958 1.254 . . . . 0.0 113.272 176.234 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 21.2 m -63.91 132.23 50.12 Favored 'General case' 0 N--CA 1.477 0.878 0 O-C-N 120.534 -1.354 . . . . 0.0 112.586 -179.803 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 158.96 -167.32 34.79 Favored Glycine 0 N--CA 1.472 1.042 0 O-C-N 121.162 -0.961 . . . . 0.0 113.725 -177.68 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.2 m -93.4 138.31 31.86 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.888 1.275 . . . . 0.0 110.721 -178.045 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -135.9 156.46 48.73 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.804 1.641 . . . . 0.0 112.556 -177.647 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -160.25 148.62 16.82 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.808 1.243 . . . . 0.0 112.332 179.184 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 4.5 m -89.13 170.49 10.57 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.293 0.568 . . . . 0.0 111.999 172.49 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -155.04 115.6 0.67 Allowed Glycine 0 CA--C 1.526 0.765 0 C-N-CA 124.532 1.063 . . . . 0.0 111.673 168.435 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -87.82 156.26 19.48 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 117.791 0.795 . . . . 0.0 111.638 172.458 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 17.8 tt -154.43 130.19 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 124.602 1.161 . . . . 0.0 110.791 174.297 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 22.8 m -67.92 159.28 30.85 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.648 1.179 . . . . 0.0 113.402 -178.25 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.81 -9.91 48.34 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 115.578 1.696 . . . . 0.0 115.578 179.012 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -75.05 142.93 76.65 Favored Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 124.335 1.054 . . . . 0.0 112.265 -179.142 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_exo -56.14 -27.75 66.96 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 123.607 2.871 . . . . 0.0 114.658 174.736 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -84.51 0.98 47.78 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.819 1.248 . . . . 0.0 114.309 -179.49 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.88 164.52 17.26 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 124.4 1.08 . . . . 0.0 113.683 -177.213 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -146.1 152.44 39.31 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.76 1.624 . . . . 0.0 109.424 178.681 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 64.9 mt -71.46 123.37 25.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 124.28 1.032 . . . . 0.0 111.023 -174.774 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -83.72 88.38 7.07 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.451 1.501 . . . . 0.0 110.742 178.268 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -74.86 152.86 38.88 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.882 0.873 . . . . 0.0 110.566 171.353 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 58.8 m -157.35 -177.39 6.56 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.104 1.362 . . . . 0.0 112.24 179.528 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.5 tt -55.65 106.96 0.29 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.316 1.846 . . . . 0.0 113.083 -170.627 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.33 156.52 15.54 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.8 1.64 . . . . 0.0 114.762 -175.538 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -118.77 169.65 9.66 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 126.865 2.066 . . . . 0.0 111.558 177.559 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -130.82 144.94 51.81 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.844 1.257 . . . . 0.0 111.821 179.605 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 55.1 tp -115.21 134.8 54.81 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 126.417 1.887 . . . . 0.0 110.178 173.771 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 60.0 ttt85 -125.9 120.62 30.89 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.791 1.636 . . . . 0.0 109.755 171.207 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 46.6 t -106.43 114.71 46.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 124.833 1.253 . . . . 0.0 108.763 174.9 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 70.3 p -98.64 146.04 26.25 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.948 1.699 . . . . 0.0 110.416 -177.972 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 -59.05 146.98 36.48 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -172.355 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 20.0 ttp-105 . . . . . 0 C--O 1.236 0.345 0 C-N-CA 124.594 1.158 . . . . 0.0 108.803 -176.036 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.2 t . . . . . 0 N--CA 1.474 0.754 0 N-CA-C 112.016 0.376 . . . . 0.0 112.016 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -129.45 132.92 47.07 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.002 1.721 . . . . 0.0 110.761 -171.05 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 92.8 p -140.86 154.99 69.22 Favored Pre-proline 0 CA--C 1.55 0.98 0 N-CA-C 113.893 1.071 . . . . 0.0 113.893 -172.283 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -66.98 160.07 79.03 Favored 'Cis proline' 0 C--N 1.353 0.804 0 CA-C-N 119.409 0.825 . . . . 0.0 111.497 -6.405 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.86 -28.68 66.33 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 176.521 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 47.8 tp -141.13 122.59 15.01 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.586 1.554 . . . . 0.0 109.049 170.252 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 54.6 tp -105.84 126.11 51.79 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.033 1.333 . . . . 0.0 109.32 170.926 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.4 t -109.08 123.77 65.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 124.028 0.931 . . . . 0.0 108.915 173.164 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.3 m -127.93 170.05 18.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 125.047 1.339 . . . . 0.0 111.474 172.86 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 18.4 m -98.16 151.74 20.1 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.472 1.509 . . . . 0.0 110.39 173.856 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -47.92 127.48 12.11 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.568 1.147 . . . . 0.0 111.45 168.777 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 86.24 -1.05 87.55 Favored Glycine 0 CA--C 1.532 1.137 0 C-N-CA 125.306 1.431 . . . . 0.0 114.664 -178.044 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.5 t0 -89.14 160.3 17.07 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.664 1.732 . . . . 0.0 111.912 173.786 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 71.4 m-20 -93.68 118.71 31.75 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.418 1.087 . . . . 0.0 110.191 175.343 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -97.88 120.44 38.28 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.875 1.27 . . . . 0.0 110.791 -179.992 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 23.1 m -125.38 125.82 44.03 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.593 0.757 . . . . 0.0 111.049 178.99 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -102.31 159.36 15.48 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.2 1.8 . . . . 0.0 111.034 172.078 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 71.3 m -113.4 126.82 55.77 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.722 1.609 . . . . 0.0 109.375 175.848 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -118.3 127.62 53.88 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.91 1.284 . . . . 0.0 111.525 179.012 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 57.6 m -118.91 139.36 51.77 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.983 1.313 . . . . 0.0 109.877 -172.278 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.427 ' CE1' HD21 ' A' ' 65' ' ' LEU . 38.1 m-85 . . . . . 0 CA--C 1.536 0.42 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -169.651 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 30.8 p90 . . . . . 0 CA--C 1.538 0.514 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 57.6 t -95.99 132.59 39.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 125.482 1.513 . . . . 0.0 107.038 167.465 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.427 HD21 ' CE1' ' A' ' 56' ' ' PHE . 0.2 OUTLIER -99.31 113.48 25.81 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.849 0.86 . . . . 0.0 109.256 176.31 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 -106.19 145.97 30.86 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.153 1.381 . . . . 0.0 111.177 179.91 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 18.5 t90 -114.83 136.36 53.18 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.669 1.188 . . . . 0.0 111.018 176.511 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -130.1 145.18 51.67 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.83 1.252 . . . . 0.0 113.998 -173.012 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 52.3 ttp85 -101.12 144.45 29.99 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 126.409 1.884 . . . . 0.0 107.64 167.017 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 33.5 mtp -90.26 145.79 24.73 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 118.948 0.794 . . . . 0.0 112.212 173.507 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 41.2 m -111.45 149.88 41.29 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 125.649 1.58 . . . . 0.0 111.071 173.805 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -69.32 -14.54 37.66 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 124.333 3.356 . . . . 0.0 114.164 -170.424 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.2 m -76.79 10.39 2.26 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.687 1.195 . . . . 0.0 112.929 171.162 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 68.15 48.82 0.9 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 127.434 2.294 . . . . 0.0 111.021 -176.565 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 26.9 mm-40 -130.72 175.71 8.8 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.441 1.496 . . . . 0.0 110.736 -178.523 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.0 p -136.13 150.99 49.32 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.938 1.695 . . . . 0.0 111.107 -177.354 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 39.6 t0 -133.99 127.72 32.93 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.573 1.549 . . . . 0.0 110.745 -177.798 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 30.6 ttmt -74.23 129.05 37.08 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.689 0.796 . . . . 0.0 110.734 -178.917 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 78.4 mt -101.35 -49.09 4.16 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 125.159 1.384 . . . . 0.0 112.294 -175.147 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -165.78 176.74 7.71 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 127.044 2.137 . . . . 0.0 109.409 -178.853 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -157.44 167.22 30.84 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.767 0.827 . . . . 0.0 113.003 -176.87 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -139.52 117.0 8.56 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 125.557 1.543 . . . . 0.0 109.4 169.405 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo . . . . . 0 C--N 1.352 0.73 0 CA-C-N 120.502 1.215 . . . . 0.0 113.656 -6.302 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 12.5 mmt85 . . . . . 0 N--CA 1.474 0.759 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -111.91 136.3 51.4 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.064 1.746 . . . . 0.0 110.081 174.311 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 12.1 mtm180 -144.52 149.26 35.61 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.7 1.2 . . . . 0.0 112.715 179.108 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 43.9 t -126.5 131.19 71.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 C-N-CA 125.69 1.596 . . . . 0.0 109.652 175.713 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 89.1 m -130.5 136.45 48.98 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.728 1.211 . . . . 0.0 110.407 178.269 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -80.28 141.89 35.08 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 118.566 0.621 . . . . 0.0 112.081 174.759 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 19.6 mt -85.48 158.62 57.15 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 123.751 0.82 . . . . 0.0 111.271 169.75 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -66.15 -4.55 10.58 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 123.656 2.904 . . . . 0.0 114.201 174.306 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -61.13 -26.15 67.48 Favored 'General case' 0 CA--C 1.551 1.007 0 CA-C-N 119.49 1.041 . . . . 0.0 112.835 169.699 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 98.73 -34.07 5.6 Favored Glycine 0 CA--C 1.531 1.078 0 C-N-CA 126.113 1.816 . . . . 0.0 114.224 172.708 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 57.1 mtm180 -135.36 73.59 1.48 Allowed 'General case' 0 N--CA 1.475 0.785 0 CA-C-O 122.616 1.198 . . . . 0.0 109.589 169.314 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -168.19 143.9 3.75 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 127.337 2.255 . . . . 0.0 108.651 -179.735 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -145.76 148.21 32.73 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.736 0.815 . . . . 0.0 112.833 -167.691 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -104.66 129.17 52.86 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.076 1.351 . . . . 0.0 110.673 168.827 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.4 mpt? -113.21 114.02 26.16 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 126.252 1.821 . . . . 0.0 108.987 -178.924 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 34.7 t -118.91 126.82 52.66 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.768 1.025 . . . . 0.0 113.768 -169.348 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 22.8 t -101.0 113.04 35.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 167.838 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 3.6 m -89.29 139.28 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-N 118.506 0.594 . . . . 0.0 111.864 179.424 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 19.9 tpt180 56.07 51.37 12.03 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.129 1.772 . . . . 0.0 111.712 173.658 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.12 158.96 24.49 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 114.589 1.329 . . . . 0.0 114.589 -168.81 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 4.8 ptm180 -135.77 151.83 50.5 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 127.816 2.446 . . . . 0.0 109.605 -172.159 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 36.1 mtp180 -53.35 -37.55 62.48 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 114.387 1.254 . . . . 0.0 114.387 -169.628 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -65.43 -13.79 59.49 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 125.053 1.341 . . . . 0.0 114.546 177.217 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -72.49 -16.69 61.79 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.978 1.263 . . . . 0.0 112.689 172.96 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.6 m -62.05 132.8 54.08 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.073 -1.017 . . . . 0.0 112.505 -177.388 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 159.76 -167.09 35.19 Favored Glycine 0 N--CA 1.473 1.112 0 C-N-CA 124.227 0.918 . . . . 0.0 114.031 -174.654 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.9 m -94.46 144.46 25.54 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.274 1.43 . . . . 0.0 110.977 -178.032 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -144.65 155.08 43.42 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.588 1.555 . . . . 0.0 111.789 -175.375 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -160.65 161.58 32.45 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.94 1.296 . . . . 0.0 113.441 179.511 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 3.5 m -104.67 162.74 13.02 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.342 1.457 . . . . 0.0 111.449 179.057 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -153.19 134.52 4.46 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 123.89 0.757 . . . . 0.0 113.369 169.883 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -99.27 126.78 45.17 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.981 0.913 . . . . 0.0 110.777 173.64 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 16.7 tt -122.28 131.36 73.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 O-C-N 121.266 -0.896 . . . . 0.0 110.857 174.888 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.2 m -61.22 157.96 15.11 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.515 1.126 . . . . 0.0 113.151 -177.92 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 39.0 mt -73.15 -14.23 61.33 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 -178.752 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -69.55 154.3 94.95 Favored Pre-proline 0 CA--C 1.552 1.055 0 C-N-CA 125.061 1.344 . . . . 0.0 112.821 176.097 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.87 -24.69 24.29 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 123.011 2.474 . . . . 0.0 112.975 176.958 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 17.2 ttpp -89.09 13.36 13.25 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 125.248 1.419 . . . . 0.0 113.461 -179.433 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.78 168.08 10.21 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.564 1.546 . . . . 0.0 114.754 -173.64 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -142.97 147.67 35.57 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.209 1.804 . . . . 0.0 109.219 177.372 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 42.8 mt -80.83 125.1 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 123.995 0.918 . . . . 0.0 111.006 -175.04 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 32.2 mmtm -88.05 93.92 9.64 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.955 1.302 . . . . 0.0 107.983 169.361 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -79.24 139.64 37.86 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.621 0.769 . . . . 0.0 112.021 -174.178 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 69.4 m -84.5 156.06 21.88 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.395 1.078 . . . . 0.0 113.33 175.073 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 89.0 mt -62.2 135.75 57.63 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 168.44 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.82 165.14 25.46 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 115.428 1.64 . . . . 0.0 115.428 -169.679 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -129.59 169.53 14.91 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 127.07 2.148 . . . . 0.0 110.55 169.548 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -122.46 142.33 50.67 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.818 1.247 . . . . 0.0 111.477 176.651 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 60.7 tp -110.34 136.27 49.77 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 125.946 1.698 . . . . 0.0 109.91 172.012 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 68.2 ttt180 -127.61 121.66 31.1 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.682 1.593 . . . . 0.0 109.756 170.07 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 45.2 t -108.0 111.85 37.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 C-N-CA 124.977 1.311 . . . . 0.0 108.641 172.755 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 75.4 p -90.8 155.2 18.96 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 125.945 1.698 . . . . 0.0 110.694 -179.647 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -65.21 148.9 50.86 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.946 0.898 . . . . 0.0 113.385 -172.463 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 34.2 ttp-105 . . . . . 0 C--O 1.236 0.362 0 C-N-CA 124.602 1.161 . . . . 0.0 109.828 -175.405 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.8 t . . . . . 0 N--CA 1.466 0.374 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -121.24 144.02 48.83 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.418 1.087 . . . . 0.0 112.301 -168.459 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 79.9 p -140.91 153.88 67.92 Favored Pre-proline 0 CA--C 1.547 0.85 0 N-CA-C 113.728 1.011 . . . . 0.0 113.728 168.732 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -70.43 159.92 90.9 Favored 'Cis proline' 0 C--N 1.352 0.738 0 CA-C-N 118.96 0.664 . . . . 0.0 111.092 -10.066 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.57 -30.44 69.79 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 173.05 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 48.0 tp -138.52 120.26 15.25 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.52 1.528 . . . . 0.0 109.005 170.103 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 41.8 tp -102.01 127.16 49.0 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.132 1.373 . . . . 0.0 109.403 172.781 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.8 t -112.43 123.1 67.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 124.022 0.929 . . . . 0.0 108.925 173.57 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.5 m -128.5 166.38 25.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 C-N-CA 124.687 1.195 . . . . 0.0 112.195 173.55 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.0 m -88.51 150.11 23.28 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.938 1.295 . . . . 0.0 110.522 172.339 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -51.73 124.95 13.6 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.587 1.155 . . . . 0.0 111.639 173.684 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 86.25 -0.87 87.48 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 124.849 1.214 . . . . 0.0 114.593 -178.412 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -85.62 158.92 19.97 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 119.598 1.699 . . . . 0.0 111.52 171.428 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 8.0 p30 -86.02 130.05 34.65 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.506 0.722 . . . . 0.0 111.276 172.145 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -111.07 119.58 39.5 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.325 1.45 . . . . 0.0 110.76 -178.161 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 34.4 m -120.55 125.57 48.15 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.985 0.914 . . . . 0.0 111.675 -176.482 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -99.99 153.12 19.45 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.739 1.615 . . . . 0.0 110.406 169.126 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 37.2 m -103.8 131.35 51.07 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.27 1.428 . . . . 0.0 108.858 171.583 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 46.4 t -121.29 124.21 44.06 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.979 1.312 . . . . 0.0 111.082 171.521 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 24.0 t -125.26 146.3 49.61 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.161 1.385 . . . . 0.0 111.181 179.964 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 34.6 p90 . . . . . 0 N--CA 1.472 0.672 0 C-N-CA 125.07 1.348 . . . . 0.0 112.188 -170.042 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 5.0 p90 . . . . . 0 CA--C 1.539 0.521 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 48.0 t -109.61 137.85 39.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 126.286 1.834 . . . . 0.0 108.52 170.866 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 15.9 tp -102.94 130.79 50.12 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 123.641 0.776 . . . . 0.0 109.619 170.074 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -126.08 158.07 36.39 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.358 1.463 . . . . 0.0 111.568 -171.495 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 15.2 t90 -130.5 138.62 50.34 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.435 1.094 . . . . 0.0 112.149 -176.761 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -139.82 147.73 41.15 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.518 1.127 . . . . 0.0 113.436 -171.928 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 79.4 ttt-85 -110.93 138.29 47.51 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.542 1.537 . . . . 0.0 108.852 168.519 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 37.7 mtp -86.39 145.9 26.68 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 119.348 0.976 . . . . 0.0 112.492 177.046 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.1 p -86.01 163.0 44.98 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 123.824 0.849 . . . . 0.0 111.929 170.689 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -67.53 -19.45 48.59 Favored 'Trans proline' 0 C--N 1.354 0.85 0 C-N-CA 122.639 2.226 . . . . 0.0 112.575 171.574 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 21.9 m -82.41 12.54 4.38 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.135 1.374 . . . . 0.0 112.806 170.029 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . 0.312 0.4 OUTLIER 61.58 21.71 12.32 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 128.252 2.621 . . . . 0.0 115.574 179.185 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 17.7 mm100 -89.25 -172.68 3.73 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.072 0.949 . . . . 0.0 109.634 168.858 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.4 p -141.59 141.83 33.47 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.601 1.561 . . . . 0.0 110.318 -174.897 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -118.01 131.44 56.48 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 125.026 1.33 . . . . 0.0 110.369 175.582 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 55.4 tttm -83.07 119.42 24.46 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.554 1.141 . . . . 0.0 110.744 -174.285 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 74.6 mt -92.56 -49.45 6.1 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 124.731 1.213 . . . . 0.0 112.313 -169.206 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -172.55 175.32 3.53 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 127.005 2.122 . . . . 0.0 109.982 -173.206 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.61 172.15 18.32 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.992 1.317 . . . . 0.0 112.2 -178.686 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -143.5 118.42 6.24 Favored Pre-proline 0 CA--C 1.547 0.838 0 C-N-CA 124.809 1.244 . . . . 0.0 110.279 169.102 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo . . . . . 0 C--N 1.351 0.708 0 CA-C-N 119.154 0.733 . . . . 0.0 111.192 -10.183 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 84.4 mtt-85 . . . . . 0 N--CA 1.466 0.371 0 CA-C-O 118.72 -0.657 . . . . 0.0 112.647 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -91.7 116.35 28.81 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.454 1.101 . . . . 0.0 111.345 -169.65 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 -137.81 139.66 40.11 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.165 0.986 . . . . 0.0 111.029 -170.455 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 97.2 t -126.5 125.53 67.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 125.288 1.435 . . . . 0.0 109.487 -177.889 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 90.7 m -130.28 129.39 43.19 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.911 1.284 . . . . 0.0 110.935 -173.768 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -78.09 137.65 38.34 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.611 1.164 . . . . 0.0 111.188 178.291 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 51.0 mt -92.61 159.4 36.58 Favored Pre-proline 0 CA--C 1.545 0.772 0 C-N-CA 124.603 1.161 . . . . 0.0 111.823 177.437 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -64.96 -6.82 13.54 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 123.515 2.81 . . . . 0.0 113.993 173.573 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -68.43 -11.62 59.99 Favored 'General case' 0 CA--C 1.557 1.244 0 CA-C-N 119.336 0.971 . . . . 0.0 112.688 169.608 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 88.4 -34.16 3.91 Favored Glycine 0 N--CA 1.475 1.235 0 C-N-CA 126.964 2.221 . . . . 0.0 115.612 168.77 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 23.7 ptt-85 -140.5 73.61 1.43 Allowed 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 123.865 1.793 . . . . 0.0 109.925 172.008 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -169.54 137.83 1.84 Allowed 'General case' 0 C--O 1.237 0.446 0 C-N-CA 127.251 2.22 . . . . 0.0 107.195 -170.884 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 -143.86 137.97 28.3 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -167.642 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -92.28 126.07 37.2 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.432 1.093 . . . . 0.0 109.178 167.161 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 40.0 mtt -120.31 112.22 18.75 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 125.309 1.443 . . . . 0.0 108.793 -178.496 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 60.9 m -115.88 132.02 56.77 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 114.727 1.38 . . . . 0.0 114.727 -166.998 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 33.5 t -97.7 91.34 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 N-CA-C 105.777 -1.934 . . . . 0.0 105.777 166.743 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 86.0 t -73.54 121.48 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 123.764 0.825 . . . . 0.0 109.551 -178.971 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 59.39 73.88 0.46 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.007 1.723 . . . . 0.0 111.4 -175.675 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -79.97 147.86 31.41 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.372 1.469 . . . . 0.0 112.93 -175.91 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -116.48 162.75 17.1 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 126.904 2.082 . . . . 0.0 110.459 179.044 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 83.6 mtm-85 -56.18 -24.98 44.98 Favored 'General case' 0 N--CA 1.483 1.176 0 O-C-N 121.174 -0.954 . . . . 0.0 113.555 171.505 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -65.37 -25.36 67.54 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 124.816 1.246 . . . . 0.0 114.112 171.63 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -81.86 -26.69 34.01 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.924 0.89 . . . . 0.0 112.649 -179.622 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 45.4 m -48.78 133.0 17.89 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.337 1.055 . . . . 0.0 112.43 177.239 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 150.67 -162.0 29.19 Favored Glycine 0 N--CA 1.469 0.84 0 C-N-CA 123.839 0.733 . . . . 0.0 113.196 -172.784 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.9 m -96.1 140.86 30.21 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.289 1.436 . . . . 0.0 110.902 -172.706 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -134.13 156.22 48.68 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.642 1.577 . . . . 0.0 112.824 -177.159 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -155.17 156.19 35.26 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.264 1.426 . . . . 0.0 112.66 173.63 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -119.93 137.27 54.14 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.338 1.855 . . . . 0.0 109.847 176.144 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -141.74 132.44 5.25 Favored Glycine 0 N--CA 1.471 0.995 0 C-N-CA 124.086 0.851 . . . . 0.0 113.51 -171.556 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -88.52 156.18 19.23 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.025 0.93 . . . . 0.0 112.001 175.253 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 17.7 tt -154.08 133.7 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 124.889 1.276 . . . . 0.0 110.43 173.965 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 77.3 p -77.45 161.59 27.85 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.423 1.089 . . . . 0.0 113.135 178.427 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.82 -2.09 11.2 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 115.297 1.592 . . . . 0.0 115.297 178.479 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -73.03 145.74 86.56 Favored Pre-proline 0 CA--C 1.551 1.012 0 C-N-CA 124.287 1.035 . . . . 0.0 112.512 -177.101 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -56.53 -30.31 82.12 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 123.408 2.739 . . . . 0.0 113.949 172.794 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 59.7 mtpt -88.98 5.05 46.05 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.131 1.372 . . . . 0.0 114.059 -178.305 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.4 162.22 18.19 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.429 1.092 . . . . 0.0 113.848 -175.758 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -150.5 151.3 32.47 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.928 1.691 . . . . 0.0 109.185 -178.881 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 52.0 mt -68.93 122.57 20.57 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 123.685 0.794 . . . . 0.0 110.436 -177.512 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -80.83 88.4 5.84 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.91 1.284 . . . . 0.0 110.181 175.726 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -76.93 158.78 30.48 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.539 1.536 . . . . 0.0 112.879 -179.118 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 6.1 t -147.57 -170.22 3.51 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.821 0.848 . . . . 0.0 113.003 169.889 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 92.6 mt -68.93 127.77 34.29 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.984 1.714 . . . . 0.0 111.23 -177.488 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 10.7 mpt_? -68.51 159.64 31.39 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 126.236 1.814 . . . . 0.0 115.132 -168.851 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.91 169.68 9.05 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 127.256 2.222 . . . . 0.0 110.63 168.709 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -131.01 144.04 51.17 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.584 1.153 . . . . 0.0 112.334 -177.103 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 64.2 tp -112.93 137.62 51.04 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 126.374 1.87 . . . . 0.0 110.206 171.604 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 72.1 ttt180 -127.95 119.27 25.17 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.702 1.601 . . . . 0.0 109.851 169.812 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 41.5 t -100.89 118.68 47.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 124.673 1.189 . . . . 0.0 108.22 169.204 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 75.2 p -97.52 157.84 15.8 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.69 1.596 . . . . 0.0 110.785 178.955 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 56.7 mp0 -62.29 151.56 36.14 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.341 1.056 . . . . 0.0 112.332 -179.347 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 39.0 ttm105 . . . . . 0 C--O 1.236 0.365 0 C-N-CA 124.102 0.961 . . . . 0.0 110.332 -177.125 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.3 t . . . . . 0 N--CA 1.47 0.532 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 57.4 t80 -150.56 118.2 6.15 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 127.217 2.207 . . . . 0.0 109.405 -174.495 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 98.2 p -140.94 160.87 56.7 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 124.49 1.116 . . . . 0.0 113.704 -170.632 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -70.64 164.0 82.87 Favored 'Cis proline' 0 C--N 1.354 0.859 0 CA-C-N 119.91 1.003 . . . . 0.0 111.548 -6.561 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.44 -23.57 66.97 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 175.0 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 44.4 tp -142.2 122.82 14.2 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.617 1.567 . . . . 0.0 108.785 171.024 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 61.4 tp -110.68 125.83 53.88 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.086 1.354 . . . . 0.0 109.07 170.685 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 12.6 p -108.04 128.37 63.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 123.969 0.907 . . . . 0.0 109.775 169.826 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.7 m -128.78 168.22 22.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 125.096 1.359 . . . . 0.0 111.716 172.924 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 88.4 m -90.72 148.83 22.33 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.372 1.069 . . . . 0.0 110.37 171.581 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -57.14 117.03 3.63 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.989 1.716 . . . . 0.0 111.174 175.743 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.0 5.62 65.91 Favored Glycine 0 CA--C 1.532 1.136 0 C-N-CA 125.464 1.506 . . . . 0.0 114.694 -175.252 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -97.06 158.16 15.56 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 119.435 1.618 . . . . 0.0 112.324 173.22 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 -72.81 131.83 42.79 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.73 1.212 . . . . 0.0 111.199 173.845 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -117.86 114.01 22.62 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.562 1.145 . . . . 0.0 111.186 178.757 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 32.8 m -124.72 125.33 43.91 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.536 0.734 . . . . 0.0 111.905 -174.273 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -101.46 158.13 16.3 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.513 1.925 . . . . 0.0 110.4 169.965 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 28.1 m -102.67 137.39 40.96 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.349 1.46 . . . . 0.0 109.597 172.684 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 39.1 t -130.28 142.76 50.53 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.068 1.347 . . . . 0.0 111.812 170.498 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.9 m -140.61 128.07 21.33 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.009 0.524 . . . . 0.0 112.285 -174.233 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 26.4 m-85 . . . . . 0 N--CA 1.472 0.653 0 C-N-CA 126.826 2.05 . . . . 0.0 113.412 175.764 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 35.1 p90 . . . . . 0 CA--C 1.54 0.584 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.3 t -95.98 125.08 48.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 N-CA-C 106.277 -1.749 . . . . 0.0 106.277 168.474 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 19.5 tp -101.94 134.84 44.5 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 123.569 0.748 . . . . 0.0 110.037 175.28 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 8.6 m-80 -132.03 145.79 51.66 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.832 1.253 . . . . 0.0 110.903 -169.773 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 11.5 t90 -111.43 140.65 45.84 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 124.596 1.158 . . . . 0.0 111.374 178.289 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -133.78 140.29 46.85 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 -175.668 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 68.3 ttt180 -96.58 140.0 31.84 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.268 1.027 . . . . 0.0 108.742 167.834 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 33.3 mtp -97.02 145.92 25.49 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -177.085 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.8 p -85.49 163.77 43.21 Favored Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 123.717 0.807 . . . . 0.0 111.355 169.258 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -67.76 -18.4 47.62 Favored 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 122.661 2.24 . . . . 0.0 112.763 172.781 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 32.7 m -83.34 1.55 40.67 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.635 1.174 . . . . 0.0 112.91 170.861 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 74.46 22.44 2.13 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 127.784 2.433 . . . . 0.0 113.759 179.424 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -83.34 177.07 8.66 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.213 0.605 . . . . 0.0 109.463 168.399 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 11.7 p -144.22 139.1 28.5 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.841 1.257 . . . . 0.0 111.098 -169.904 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -122.51 130.11 52.7 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.028 0.931 . . . . 0.0 111.5 174.679 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -73.01 126.94 31.13 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.372 0.669 . . . . 0.0 111.021 -179.258 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 43.4 mt -98.27 -46.37 5.84 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.739 1.615 . . . . 0.0 111.989 -173.698 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -167.83 167.79 12.76 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 127.167 2.187 . . . . 0.0 109.784 -174.04 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -156.75 160.2 39.05 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.392 1.077 . . . . 0.0 112.372 -176.212 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -133.76 130.67 20.79 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 124.861 1.264 . . . . 0.0 110.21 170.607 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo . . . . . 0 C--N 1.351 0.673 0 CA-C-N 119.932 1.012 . . . . 0.0 111.473 -3.928 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 12.4 mtp85 . . . . . 0 N--CA 1.466 0.339 0 N-CA-C 115.344 1.609 . . . . 0.0 115.344 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -118.3 140.47 49.78 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.137 1.775 . . . . 0.0 111.318 -174.156 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 31.4 ttp-105 -140.11 144.1 36.59 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.163 1.385 . . . . 0.0 111.465 -174.493 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 46.3 t -121.87 127.87 75.53 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 C-N-CA 124.887 1.275 . . . . 0.0 108.485 169.18 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 89.3 m -130.6 134.88 47.35 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.173 1.389 . . . . 0.0 110.403 -174.365 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 22.1 pt20 -79.92 141.66 35.86 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.574 0.749 . . . . 0.0 111.887 173.851 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 72.3 mt -93.9 158.38 36.44 Favored Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 124.904 1.282 . . . . 0.0 111.675 178.171 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -65.56 -4.72 10.13 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 123.549 2.832 . . . . 0.0 113.848 174.209 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 21.2 m120 -65.19 -18.53 65.39 Favored 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 119.15 0.886 . . . . 0.0 113.044 169.97 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 95.66 -34.14 5.07 Favored Glycine 0 N--CA 1.474 1.168 0 C-N-CA 126.457 1.98 . . . . 0.0 114.241 169.884 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 90.4 mtt-85 -141.41 73.65 1.43 Allowed 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.571 1.549 . . . . 0.0 109.173 169.308 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -164.82 144.81 7.28 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 126.787 2.035 . . . . 0.0 108.087 178.706 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -142.65 147.35 35.61 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 -168.055 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -105.19 138.63 41.08 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.163 1.385 . . . . 0.0 110.917 168.884 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 31.5 mtt -121.42 108.66 13.93 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 126.238 1.815 . . . . 0.0 107.816 179.32 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 17.5 t -122.26 128.35 51.0 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 -165.994 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 12.9 t -88.32 124.9 41.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 125.269 1.428 . . . . 0.0 107.356 168.073 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 67.4 t -84.29 112.48 21.61 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 C-N-CA 124.916 1.287 . . . . 0.0 108.887 174.535 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 80.7 mtt85 54.97 70.39 0.63 Allowed 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.714 1.605 . . . . 0.0 111.656 175.997 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.64 128.46 36.05 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.196 0.998 . . . . 0.0 111.792 -174.391 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 10.1 mpt_? -89.22 161.94 16.16 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.945 1.298 . . . . 0.0 109.828 173.557 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 71.8 mtm180 -58.73 -23.72 60.32 Favored 'General case' 0 N--CA 1.484 1.255 0 O-C-N 120.628 -1.295 . . . . 0.0 113.578 172.676 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -55.01 -26.88 40.02 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.576 1.551 . . . . 0.0 113.367 167.99 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 34.9 m-20 -95.73 -1.22 50.33 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.584 1.554 . . . . 0.0 113.207 -169.46 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 69.4 m -64.4 138.31 58.35 Favored 'General case' 0 CA--C 1.544 0.727 0 O-C-N 120.401 -1.437 . . . . 0.0 111.643 169.837 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 160.1 -167.41 35.47 Favored Glycine 0 N--CA 1.473 1.12 0 O-C-N 121.167 -0.958 . . . . 0.0 113.608 178.866 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.8 m -93.84 145.54 24.53 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.464 0.706 . . . . 0.0 110.004 175.701 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -139.56 158.99 43.19 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.85 2.06 . . . . 0.0 110.281 -178.671 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.9 pp -152.83 167.16 29.97 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.96 0.904 . . . . 0.0 112.558 171.095 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 50.4 t -114.32 144.76 42.73 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.676 1.591 . . . . 0.0 110.935 -178.767 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -147.79 139.04 7.49 Favored Glycine 0 N--CA 1.472 1.094 0 C-N-CA 124.031 0.824 . . . . 0.0 113.906 177.584 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -109.46 159.21 17.23 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.728 1.211 . . . . 0.0 112.387 179.161 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.4 tt -146.68 131.77 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 125.321 1.448 . . . . 0.0 109.355 169.377 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.3 m -67.29 152.33 45.91 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.449 1.1 . . . . 0.0 111.92 -177.905 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 3.7 pp -70.72 -11.5 60.98 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 115.372 1.619 . . . . 0.0 115.372 -170.936 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -74.32 148.03 85.77 Favored Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 123.808 0.843 . . . . 0.0 112.069 174.924 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -67.54 -18.74 48.94 Favored 'Trans proline' 0 CA--C 1.54 0.775 0 C-N-CA 123.189 2.593 . . . . 0.0 113.383 -179.015 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -76.83 -10.15 59.17 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.839 1.256 . . . . 0.0 113.718 176.433 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.25 162.32 20.29 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.931 1.292 . . . . 0.0 114.024 -175.106 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -137.92 157.96 45.33 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.109 1.764 . . . . 0.0 109.434 174.75 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 65.4 mt -72.91 132.55 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 123.386 0.674 . . . . 0.0 110.944 -177.986 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -122.34 135.29 54.69 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.772 2.029 . . . . 0.0 110.093 173.389 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -112.65 148.0 35.56 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.181 0.992 . . . . 0.0 113.524 -167.662 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 69.8 m -84.58 -175.45 5.79 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.428 1.491 . . . . 0.0 111.918 168.867 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -63.35 156.48 25.68 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.121 0.968 . . . . 0.0 110.552 168.924 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -93.84 155.45 17.19 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.17 0.988 . . . . 0.0 111.613 172.855 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -147.79 159.96 43.25 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.141 1.376 . . . . 0.0 112.291 -176.029 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -104.12 138.44 40.61 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.913 1.285 . . . . 0.0 112.046 -175.013 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 46.9 tp -109.91 126.7 54.15 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 125.998 1.719 . . . . 0.0 108.688 169.212 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 70.9 ttt180 -118.34 119.38 34.46 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.975 1.71 . . . . 0.0 109.603 175.531 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 43.8 t -104.09 120.39 54.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 C-N-CA 124.341 1.057 . . . . 0.0 108.582 170.367 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 68.1 p -98.9 150.07 22.29 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.308 1.443 . . . . 0.0 109.727 175.435 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 37.1 mp0 -50.73 150.49 2.83 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.978 1.311 . . . . 0.0 112.867 -177.971 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 57.7 ttp180 . . . . . 0 C--O 1.236 0.353 0 C-N-CA 124.449 1.099 . . . . 0.0 109.496 -178.11 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 37.2 p . . . . . 0 N--CA 1.476 0.864 0 CA-C-O 120.574 0.226 . . . . 0.0 111.067 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -121.46 134.13 55.07 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.255 1.422 . . . . 0.0 110.117 178.533 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.4 m -140.83 157.45 67.53 Favored Pre-proline 0 N--CA 1.477 0.892 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 179.918 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -70.64 157.87 94.14 Favored 'Cis proline' 0 C--N 1.351 0.662 0 CA-C-N 119.327 0.795 . . . . 0.0 110.887 -8.993 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -57.69 -32.7 67.62 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 172.146 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 50.6 tp -138.93 120.37 14.96 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.531 1.533 . . . . 0.0 109.342 170.733 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 50.6 tp -100.62 127.27 47.07 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.524 1.53 . . . . 0.0 109.24 171.146 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.7 t -111.52 124.61 68.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 124.099 0.96 . . . . 0.0 108.562 171.805 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.1 m -127.58 164.32 28.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 124.493 1.117 . . . . 0.0 111.562 173.959 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 16.8 m -88.33 151.27 22.73 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.681 1.193 . . . . 0.0 110.472 173.662 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.12 120.53 2.45 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.942 1.697 . . . . 0.0 112.563 171.634 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.18 1.08 89.64 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 125.868 1.699 . . . . 0.0 115.408 179.692 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -85.13 157.26 20.73 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 119.65 1.725 . . . . 0.0 111.914 175.744 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -82.54 123.53 29.29 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.696 0.798 . . . . 0.0 110.353 177.548 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -104.55 123.79 48.16 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.667 1.187 . . . . 0.0 110.928 -178.529 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 36.0 m -132.3 126.87 34.37 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.002 0.921 . . . . 0.0 111.516 -175.963 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -100.37 153.98 18.88 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 126.1 1.76 . . . . 0.0 110.837 171.027 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 39.4 m -101.53 128.41 47.79 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 125.266 1.426 . . . . 0.0 108.572 169.759 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 95.6 m -124.67 128.77 49.34 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.606 1.162 . . . . 0.0 109.538 170.603 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.9 m -111.0 127.85 55.66 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.744 0.818 . . . . 0.0 109.884 -173.923 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 . . . . . 0 CA--C 1.534 0.339 0 C-N-CA 124.239 1.016 . . . . 0.0 110.874 174.912 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 49.2 p90 . . . . . 0 CA--C 1.54 0.57 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 24.2 t -125.77 119.93 56.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 125.0 1.32 . . . . 0.0 107.878 168.648 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 59.0 tp -99.43 139.4 35.14 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 124.819 1.247 . . . . 0.0 108.662 169.601 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 9.7 m-80 -133.8 152.8 51.98 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.761 1.224 . . . . 0.0 111.193 -170.809 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 24.0 t90 -128.19 139.41 52.49 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.871 1.268 . . . . 0.0 111.04 175.469 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -135.31 143.41 46.16 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 114.677 1.362 . . . . 0.0 114.677 -170.404 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 55.9 ttp85 -93.14 144.46 25.26 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.913 1.685 . . . . 0.0 107.104 165.614 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 28.9 mtp -96.91 145.95 25.41 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 118.945 0.793 . . . . 0.0 112.244 172.62 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 59.3 m -102.89 158.64 31.35 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 125.029 1.331 . . . . 0.0 111.301 169.809 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_exo -56.6 -30.97 85.36 Favored 'Trans proline' 0 C--N 1.355 0.917 0 C-N-CA 124.405 3.403 . . . . 0.0 115.163 -172.97 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 14.3 m -77.02 11.86 1.62 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.001 1.32 . . . . 0.0 113.655 178.094 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 46.3 t30 69.12 25.4 5.81 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 127.164 2.186 . . . . 0.0 112.445 -176.913 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -92.72 170.51 9.66 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.203 1.001 . . . . 0.0 110.628 172.85 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 9.9 p -134.74 152.55 51.85 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.457 1.503 . . . . 0.0 111.555 -174.722 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 43.4 t0 -136.47 125.77 24.84 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.701 1.601 . . . . 0.0 110.042 -177.823 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 12.7 ttmm -75.05 126.13 30.38 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.235 0.541 . . . . 0.0 110.734 -175.875 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 91.0 mt -95.37 -49.43 5.45 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.248 1.419 . . . . 0.0 111.147 -177.8 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -160.82 176.72 11.16 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.41 1.484 . . . . 0.0 110.445 177.296 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -152.85 166.7 31.46 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.862 1.265 . . . . 0.0 112.043 -174.857 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -137.72 115.27 9.6 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 126.033 1.733 . . . . 0.0 109.117 172.587 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo . . . . . 0 C--N 1.352 0.715 0 CA-C-N 120.289 1.139 . . . . 0.0 113.935 -5.803 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 . . . . . 0 N--CA 1.472 0.625 0 N-CA-C 114.271 1.212 . . . . 0.0 114.271 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -101.91 127.23 48.84 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.916 1.286 . . . . 0.0 110.118 176.498 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -134.2 143.12 47.67 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.412 1.085 . . . . 0.0 112.197 -171.133 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 26.0 t -126.56 127.7 70.54 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 125.14 1.376 . . . . 0.0 109.232 168.562 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 90.3 m -130.52 137.38 49.7 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.479 1.512 . . . . 0.0 110.779 -174.286 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 65.4 tt0 -86.02 134.73 33.83 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.119 0.968 . . . . 0.0 110.59 172.188 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 65.8 mt -87.13 158.92 52.07 Favored Pre-proline 0 CA--C 1.542 0.635 0 C-N-CA 124.203 1.001 . . . . 0.0 112.064 -179.281 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -63.97 -6.97 12.15 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 123.645 2.897 . . . . 0.0 114.017 173.8 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -64.58 -26.04 68.23 Favored 'General case' 0 CA--C 1.552 1.022 0 CA-C-N 119.559 1.072 . . . . 0.0 112.191 169.094 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 92.98 -34.04 4.75 Favored Glycine 0 CA--C 1.53 1.018 0 C-N-CA 126.556 2.027 . . . . 0.0 113.591 174.637 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 22.9 ptt180 -130.75 73.54 1.55 Allowed 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 122.835 1.302 . . . . 0.0 110.378 171.003 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -175.47 143.94 0.66 Allowed 'General case' 0 C--O 1.237 0.398 0 C-N-CA 127.393 2.277 . . . . 0.0 109.14 -177.663 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -142.51 148.31 37.43 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -168.782 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 10.0 m170 -107.31 134.88 49.73 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.26 1.424 . . . . 0.0 111.621 170.442 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -119.92 121.36 38.84 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 126.192 1.797 . . . . 0.0 107.923 178.002 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 22.7 t -133.78 137.04 44.93 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 116.285 1.958 . . . . 0.0 116.285 -166.721 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 48.4 t -96.58 116.26 38.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 C-N-CA 126.906 2.083 . . . . 0.0 107.318 168.265 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 88.5 t -76.83 127.29 37.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 123.657 0.783 . . . . 0.0 109.026 169.599 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 54.4 ttt85 54.75 71.33 0.54 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.931 1.693 . . . . 0.0 111.551 176.864 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -69.83 129.42 39.51 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.627 0.771 . . . . 0.0 110.98 -177.535 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 37.7 mmm-85 -103.74 161.91 13.53 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 126.019 1.727 . . . . 0.0 110.268 179.492 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 3.2 mmm180 -51.81 -34.28 39.37 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 121.009 -1.057 . . . . 0.0 113.418 -179.628 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -66.89 -19.49 65.74 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.408 1.483 . . . . 0.0 115.001 176.81 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -75.9 -13.7 60.26 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 119.831 1.196 . . . . 0.0 113.144 177.992 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.2 m -62.83 129.16 39.23 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 120.661 -1.275 . . . . 0.0 112.156 179.998 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 161.3 -166.46 35.84 Favored Glycine 0 CA--C 1.529 0.924 0 C-N-CA 124.111 0.863 . . . . 0.0 113.246 -173.583 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.6 m -96.83 144.28 26.94 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.664 1.186 . . . . 0.0 110.833 -177.244 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -143.03 158.29 43.74 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.363 1.865 . . . . 0.0 111.321 -175.553 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.2 pp -158.64 166.53 31.84 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.555 1.142 . . . . 0.0 112.208 174.295 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 71.3 m -113.61 162.12 16.6 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.889 1.275 . . . . 0.0 111.268 177.384 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -156.72 133.89 3.81 Favored Glycine 0 N--CA 1.471 0.977 0 O-C-N 121.529 -0.732 . . . . 0.0 114.12 176.462 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -114.52 147.85 38.79 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.285 1.034 . . . . 0.0 112.685 -178.451 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 16.9 tt -153.96 147.97 13.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.296 1.438 . . . . 0.0 111.035 -179.389 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 66.1 m -77.63 150.73 34.58 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 120.918 -1.114 . . . . 0.0 110.689 169.493 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.86 -4.9 37.72 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 115.413 1.635 . . . . 0.0 115.413 -174.333 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -75.05 147.18 83.3 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 124.68 1.192 . . . . 0.0 111.894 174.134 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -68.77 -17.14 42.31 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 123.434 2.756 . . . . 0.0 113.77 -176.613 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -73.66 -16.14 61.22 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.532 1.133 . . . . 0.0 113.575 176.268 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -71.67 168.1 18.43 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.137 1.375 . . . . 0.0 113.765 -176.052 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.54 149.06 35.24 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.125 1.77 . . . . 0.0 108.664 176.866 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 34.0 mt -75.48 121.61 27.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 123.893 0.877 . . . . 0.0 110.928 -175.123 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 36.6 tptt -81.81 115.31 20.97 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.683 0.793 . . . . 0.0 109.769 168.985 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -108.91 158.87 17.28 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.723 2.009 . . . . 0.0 110.587 174.226 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 5.6 t -143.96 -168.03 2.75 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.369 1.068 . . . . 0.0 112.156 176.384 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 98.7 mt -60.82 117.5 5.48 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.874 1.669 . . . . 0.0 111.884 -172.478 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 20.2 ptp180 -66.32 157.86 30.61 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.656 1.582 . . . . 0.0 113.632 -174.67 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -122.36 165.75 15.79 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 127.038 2.135 . . . . 0.0 111.52 -175.057 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -128.01 143.13 51.07 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.585 1.154 . . . . 0.0 111.885 -177.657 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 56.4 tp -113.27 135.94 53.29 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 126.196 1.798 . . . . 0.0 109.97 172.563 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -126.66 123.23 37.1 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.81 1.644 . . . . 0.0 109.539 169.726 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 46.5 t -103.01 124.35 57.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 107.143 -1.429 . . . . 0.0 107.143 169.275 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 67.5 p -101.3 155.3 18.12 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.313 1.445 . . . . 0.0 110.904 177.25 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -58.75 150.81 22.65 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.752 0.787 . . . . 0.0 112.845 178.645 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.466 0.349 0 C-N-CA 124.323 1.049 . . . . 0.0 109.049 -179.471 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 85.5 m . . . . . 0 N--CA 1.476 0.863 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -145.08 114.45 7.11 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.152 1.781 . . . . 0.0 109.755 172.793 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 69.2 m -140.91 160.06 59.81 Favored Pre-proline 0 N--CA 1.479 0.976 0 C-N-CA 124.762 1.225 . . . . 0.0 113.069 -170.895 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -71.21 158.71 94.9 Favored 'Cis proline' 0 C--N 1.353 0.788 0 CA-C-N 120.152 1.09 . . . . 0.0 111.531 -4.261 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.55 -25.21 64.35 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 175.387 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 45.2 tp -142.45 122.55 13.73 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.445 1.498 . . . . 0.0 109.044 169.988 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 61.6 tp -108.74 125.47 51.96 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.21 1.404 . . . . 0.0 108.881 169.75 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 12.8 p -108.79 129.33 63.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 123.877 0.871 . . . . 0.0 109.653 169.629 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 28.5 m -130.23 163.09 36.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 124.952 1.301 . . . . 0.0 111.42 173.07 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 16.3 m -84.77 147.47 26.84 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.079 0.951 . . . . 0.0 109.963 170.223 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 64.7 tt0 -56.43 124.95 19.91 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 124.931 1.292 . . . . 0.0 110.696 173.524 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.91 -2.78 84.47 Favored Glycine 0 CA--C 1.532 1.139 0 C-N-CA 126.085 1.802 . . . . 0.0 114.781 -174.795 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -87.58 160.99 17.98 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 119.35 1.575 . . . . 0.0 111.748 172.263 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -87.05 121.44 29.51 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.328 1.051 . . . . 0.0 110.495 177.331 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -97.61 128.49 44.37 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.393 1.077 . . . . 0.0 110.601 177.481 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 97.0 m -132.68 127.05 33.97 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 119.336 0.971 . . . . 0.0 111.84 176.125 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -100.99 159.48 15.17 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.609 1.964 . . . . 0.0 110.409 169.302 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 59.1 m -103.8 134.28 47.38 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.144 1.378 . . . . 0.0 109.312 171.451 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 3.3 t -137.15 142.27 42.22 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.579 1.152 . . . . 0.0 112.366 177.943 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 90.5 p -147.05 154.18 40.87 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 121.065 -1.022 . . . . 0.0 113.115 -176.877 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 . . . . . 0 N--CA 1.469 0.499 0 C-N-CA 126.429 1.892 . . . . 0.0 112.34 -172.467 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 55.6 p90 . . . . . 0 CA--C 1.539 0.524 0 CA-C-O 120.996 0.426 . . . . 0.0 112.134 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 48.8 t -95.98 127.86 47.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 125.154 1.381 . . . . 0.0 107.274 169.909 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.0 tt -99.37 119.75 38.47 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 173.277 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 23.2 m-80 -112.79 149.41 33.07 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.14 1.376 . . . . 0.0 111.146 179.349 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 11.5 t90 -119.25 142.1 48.34 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.72 1.208 . . . . 0.0 111.7 175.807 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -137.15 149.12 47.07 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.705 1.202 . . . . 0.0 113.769 -169.976 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 79.0 ttt-85 -108.04 140.28 41.44 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.397 1.479 . . . . 0.0 108.252 167.348 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 29.0 mtp -84.41 145.91 27.94 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.59 0.632 . . . . 0.0 112.35 178.345 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 66.0 m -107.64 153.2 41.57 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 125.266 1.426 . . . . 0.0 112.026 179.912 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -56.0 -30.03 76.34 Favored 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 124.69 3.593 . . . . 0.0 115.202 -177.286 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.3 m -76.98 10.16 2.49 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.843 1.257 . . . . 0.0 113.491 178.844 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 67.96 44.85 1.44 Allowed 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.825 2.05 . . . . 0.0 110.585 -175.223 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -124.09 -172.69 2.59 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.518 1.527 . . . . 0.0 109.946 177.892 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.2 p -146.01 148.13 32.38 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.719 1.608 . . . . 0.0 110.403 -174.333 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -124.69 132.59 53.39 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 124.126 0.97 . . . . 0.0 111.258 173.196 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 29.9 ttmt -76.2 126.0 30.19 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.684 1.193 . . . . 0.0 110.766 -179.41 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 66.3 mt -101.54 -51.98 3.33 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 125.501 1.52 . . . . 0.0 111.75 -170.412 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -160.46 160.86 32.6 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 127.009 2.123 . . . . 0.0 108.767 -171.963 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.57 165.4 32.95 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.65 0.78 . . . . 0.0 111.867 -174.936 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -138.19 115.61 9.31 Favored Pre-proline 0 CA--C 1.545 0.763 0 C-N-CA 124.678 1.191 . . . . 0.0 110.749 171.105 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo . . . . . 0 C--N 1.352 0.724 0 CA-C-N 119.253 0.769 . . . . 0.0 110.941 -11.659 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 48.6 mtm180 . . . . . 0 N--CA 1.472 0.627 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 80.3 m-85 -69.81 125.78 27.75 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.01 1.324 . . . . 0.0 111.24 173.025 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 8.2 tmm_? -144.47 139.9 28.59 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.55 1.54 . . . . 0.0 111.915 -169.623 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 65.2 t -119.31 133.46 66.06 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 C-N-CA 125.122 1.369 . . . . 0.0 110.378 172.462 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 45.2 m -127.16 134.42 50.18 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 125.509 1.523 . . . . 0.0 110.473 177.767 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -84.08 138.04 33.26 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.743 1.217 . . . . 0.0 111.022 175.459 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 45.6 mt -93.73 159.19 35.24 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 124.828 1.251 . . . . 0.0 111.695 177.768 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -65.56 -4.47 9.67 Favored 'Trans proline' 0 CA--C 1.542 0.92 0 C-N-CA 123.538 2.825 . . . . 0.0 114.293 174.976 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -68.23 -13.11 62.0 Favored 'General case' 0 CA--C 1.553 1.058 0 CA-C-N 119.454 1.025 . . . . 0.0 112.948 169.825 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 93.84 -34.12 4.83 Favored Glycine 0 N--CA 1.475 1.272 0 C-N-CA 126.66 2.076 . . . . 0.0 114.889 169.327 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 31.0 ptt-85 -146.12 73.63 1.34 Allowed 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 123.967 1.842 . . . . 0.0 110.138 169.792 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -161.58 141.03 10.12 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 128.872 2.869 . . . . 0.0 106.232 -176.349 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -146.09 148.5 32.7 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 -166.696 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 -100.08 122.33 42.78 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.182 1.393 . . . . 0.0 110.135 168.462 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -105.74 105.81 16.02 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 126.653 1.981 . . . . 0.0 108.291 179.975 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.2 m -114.69 145.6 41.85 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -168.704 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 11.0 t -116.82 106.41 20.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 126.588 1.955 . . . . 0.0 106.37 167.313 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 79.4 t -68.61 127.22 30.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 174.069 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 57.4 ttm-85 53.87 68.14 0.89 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.1 1.36 . . . . 0.0 111.457 170.74 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -70.76 138.21 50.28 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.0 0.92 . . . . 0.0 112.118 -173.883 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 8.7 mpt_? -107.67 158.63 17.11 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 126.028 1.731 . . . . 0.0 109.743 175.211 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 40.1 mtp180 -56.15 -32.27 64.13 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 -172.245 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 5.0 p-10 -64.67 -18.68 65.19 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 114.998 1.481 . . . . 0.0 114.998 175.955 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -71.62 -24.78 61.94 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.085 0.857 . . . . 0.0 112.317 177.169 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 19.3 m -54.71 141.55 31.86 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.254 1.022 . . . . 0.0 112.746 -178.37 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 146.98 -163.77 28.61 Favored Glycine 0 N--CA 1.471 1.029 0 C-N-CA 124.432 1.015 . . . . 0.0 113.083 -174.414 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.3 m -92.0 141.04 29.05 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.406 1.082 . . . . 0.0 110.599 -178.308 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 33.6 m-85 -132.57 159.63 38.92 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.779 2.032 . . . . 0.0 110.942 178.818 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -166.25 155.84 11.76 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.61 1.564 . . . . 0.0 112.033 179.909 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 30.8 m -99.53 159.93 14.66 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.873 0.869 . . . . 0.0 112.036 172.86 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -148.06 122.12 1.47 Allowed Glycine 0 CA--C 1.525 0.713 0 C-N-CA 124.836 1.208 . . . . 0.0 111.954 169.668 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -91.55 156.77 17.43 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.592 0.757 . . . . 0.0 111.437 173.886 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.1 tt -152.99 133.05 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 124.453 1.101 . . . . 0.0 110.526 176.654 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 8.5 m -65.42 161.47 19.78 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.739 1.216 . . . . 0.0 113.464 -175.079 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -60.51 -21.78 62.85 Favored 'General case' 0 CA--C 1.547 0.827 0 N-CA-C 115.573 1.694 . . . . 0.0 115.573 -179.258 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -78.33 143.5 64.69 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 124.318 1.047 . . . . 0.0 112.702 -174.755 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -57.35 -25.6 66.41 Favored 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 123.556 2.837 . . . . 0.0 114.514 173.349 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -81.63 -0.79 44.08 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 125.058 1.343 . . . . 0.0 113.811 179.723 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.43 167.6 10.37 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.917 1.287 . . . . 0.0 114.164 -176.242 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -143.06 153.75 43.26 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 126.508 1.923 . . . . 0.0 108.811 179.717 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 99.1 mt -71.64 123.62 26.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 CA-C-O 121.583 0.706 . . . . 0.0 111.98 -174.793 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.92 99.13 11.91 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.801 1.64 . . . . 0.0 106.83 167.326 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -84.6 137.89 33.03 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.323 0.649 . . . . 0.0 111.187 -171.497 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 8.1 t -94.89 -175.43 3.56 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.537 1.135 . . . . 0.0 113.098 179.613 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 9.8 mp -60.94 149.7 35.64 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.347 1.859 . . . . 0.0 111.285 178.788 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -92.76 141.87 27.97 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.384 1.074 . . . . 0.0 109.808 172.155 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -147.26 164.16 34.08 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.755 1.222 . . . . 0.0 111.839 175.875 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -109.44 139.86 43.9 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.217 1.007 . . . . 0.0 112.671 -170.492 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 64.1 tp -108.48 132.15 54.1 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 125.915 1.686 . . . . 0.0 108.963 168.614 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 62.5 ttm-85 -123.83 115.92 22.11 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.754 1.622 . . . . 0.0 109.702 174.028 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 48.7 t -102.78 113.81 40.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 124.372 1.069 . . . . 0.0 108.75 172.006 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 65.0 p -93.65 146.83 23.54 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.605 1.562 . . . . 0.0 109.885 177.95 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -62.79 148.7 46.08 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 121.413 -0.804 . . . . 0.0 112.91 -175.782 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 45.8 ttt85 . . . . . 0 N--CA 1.467 0.383 0 C-N-CA 124.047 0.939 . . . . 0.0 110.257 -173.943 . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.8 p . . . . . 0 N--CA 1.473 0.688 0 CA-C-O 121.465 0.65 . . . . 0.0 112.125 . . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -146.33 120.22 9.33 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.912 1.685 . . . . 0.0 109.159 -178.159 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 80.5 p -140.97 159.37 62.25 Favored Pre-proline 0 CA--C 1.55 0.947 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -169.872 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -69.59 161.46 85.63 Favored 'Cis proline' 0 C--N 1.354 0.833 0 CA-C-N 119.551 0.875 . . . . 0.0 111.501 -6.434 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.48 -24.65 67.91 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 113.169 0.803 . . . . 0.0 113.169 176.052 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 46.7 tp -140.4 120.77 14.01 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.568 1.547 . . . . 0.0 108.761 169.854 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 55.4 tp -105.96 125.79 51.42 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.267 1.427 . . . . 0.0 109.029 170.635 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.4 t -110.27 124.39 66.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 124.082 0.953 . . . . 0.0 108.563 173.041 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.6 m -128.3 164.71 29.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 C-N-CA 124.644 1.178 . . . . 0.0 111.635 174.421 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 18.3 m -90.83 148.8 22.27 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.707 1.203 . . . . 0.0 110.437 173.962 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -53.18 123.68 12.45 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.823 1.249 . . . . 0.0 111.406 176.428 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 89.12 -1.56 82.92 Favored Glycine 0 CA--C 1.533 1.199 0 C-N-CA 125.869 1.7 . . . . 0.0 114.826 -177.298 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -86.72 156.68 19.86 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 119.597 1.698 . . . . 0.0 111.877 173.217 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -83.88 123.68 30.18 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.856 0.862 . . . . 0.0 110.294 175.682 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -101.48 129.15 47.48 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.478 1.111 . . . . 0.0 110.894 179.182 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 65.3 m -132.77 126.61 32.8 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.895 0.878 . . . . 0.0 111.533 -178.573 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -101.68 152.12 21.21 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.729 1.612 . . . . 0.0 110.812 169.747 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.6 m -100.72 126.77 47.29 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.639 1.576 . . . . 0.0 109.236 175.853 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 49.4 t -117.97 138.5 52.13 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.382 1.873 . . . . 0.0 111.124 177.561 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 74.1 m -137.55 126.93 24.82 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.528 -0.733 . . . . 0.0 110.17 176.054 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 . . . . . 0 CA--C 1.534 0.329 0 C-N-CA 125.707 1.603 . . . . 0.0 113.978 175.838 . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 46.1 p90 . . . . . 0 CA--C 1.538 0.489 0 CA-C-O 121.012 0.434 . . . . 0.0 112.075 . . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 93.8 t -95.9 125.36 48.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 125.119 1.368 . . . . 0.0 107.332 169.378 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 56.8 tp -99.95 136.94 39.11 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.978 0.911 . . . . 0.0 110.29 178.059 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 -127.25 160.29 31.74 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.397 1.479 . . . . 0.0 110.627 -176.58 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 19.0 t90 -126.38 139.79 53.0 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.075 1.35 . . . . 0.0 111.427 179.606 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -136.13 144.52 45.11 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.763 1.225 . . . . 0.0 113.749 -171.82 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 56.8 ttt85 -102.49 140.15 37.14 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.886 1.674 . . . . 0.0 107.789 167.162 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 35.4 mtp -89.64 145.94 24.89 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 118.98 0.809 . . . . 0.0 112.318 176.235 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.1 p -89.16 162.06 38.61 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 123.824 0.849 . . . . 0.0 111.991 172.141 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -67.79 -18.87 47.52 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 122.755 2.303 . . . . 0.0 112.642 172.413 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.6 m -80.8 3.99 20.58 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 124.744 1.218 . . . . 0.0 113.042 170.83 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 63.7 t30 70.97 26.38 3.6 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 127.329 2.252 . . . . 0.0 113.24 178.5 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -96.71 -172.7 2.54 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.408 1.083 . . . . 0.0 109.755 169.705 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.0 p -141.6 145.16 34.71 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.619 1.567 . . . . 0.0 110.698 -174.372 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -124.72 130.58 52.69 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 125.035 1.334 . . . . 0.0 110.776 175.821 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 37.5 tttm -83.77 119.1 24.4 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.61 1.164 . . . . 0.0 111.66 -173.134 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 57.5 mt -93.55 -49.19 6.01 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.559 1.544 . . . . 0.0 112.446 -169.278 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -166.5 176.38 7.39 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.289 1.836 . . . . 0.0 110.546 -173.798 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -158.48 163.47 37.1 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.721 1.209 . . . . 0.0 112.674 -175.142 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -137.62 122.72 12.49 Favored Pre-proline 0 CA--C 1.549 0.904 0 C-N-CA 125.569 1.548 . . . . 0.0 109.802 169.977 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo . . . . . 0 C--N 1.352 0.726 0 CA-C-N 120.056 1.056 . . . . 0.0 111.745 -4.251 . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 1.7 ptm85 . . . . . 0 N--CA 1.471 0.592 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 . . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -101.01 126.25 47.67 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.196 1.398 . . . . 0.0 110.267 179.065 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 79.3 mtm180 -134.25 149.81 50.98 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.705 1.202 . . . . 0.0 111.858 -178.24 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 46.6 t -126.5 130.98 71.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 125.112 1.365 . . . . 0.0 109.334 171.11 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 92.4 m -130.53 132.73 45.74 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.687 1.195 . . . . 0.0 110.233 -179.48 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -80.58 141.74 34.76 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.37 0.668 . . . . 0.0 111.824 173.548 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 26.4 mt -90.36 158.29 43.65 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 124.03 0.932 . . . . 0.0 111.342 173.604 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -66.73 -4.69 11.58 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 123.61 2.873 . . . . 0.0 113.97 174.814 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 23.7 m120 -64.31 -18.99 65.13 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.167 0.987 . . . . 0.0 113.428 172.439 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 95.18 -20.92 46.95 Favored Glycine 0 N--CA 1.474 1.205 0 C-N-CA 125.77 1.652 . . . . 0.0 115.392 169.715 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -154.5 73.53 0.91 Allowed 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.468 1.507 . . . . 0.0 109.914 171.288 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -170.39 136.97 1.39 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 127.707 2.403 . . . . 0.0 107.662 -171.99 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 70.8 m-85 -145.18 145.81 31.5 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.891 0.877 . . . . 0.0 112.916 -168.192 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -101.76 125.83 48.5 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.236 1.415 . . . . 0.0 111.433 169.998 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -104.91 112.96 26.28 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.819 2.048 . . . . 0.0 108.419 174.884 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 67.6 m -122.03 129.18 52.22 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 115.147 1.536 . . . . 0.0 115.147 -167.954 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 44.3 t -96.36 116.49 38.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 125.916 1.687 . . . . 0.0 107.532 168.288 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 85.7 t -78.63 125.84 38.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 124.158 0.983 . . . . 0.0 110.177 176.412 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 51.11 66.71 1.1 Allowed 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 126.218 1.807 . . . . 0.0 112.157 175.456 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.42 130.48 43.19 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.508 1.123 . . . . 0.0 111.572 -173.352 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.03 169.58 8.59 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.952 1.701 . . . . 0.0 110.274 171.706 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 27.7 mtp180 -56.29 -30.71 62.86 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 121.208 -0.932 . . . . 0.0 113.373 -177.098 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 29.7 t30 -60.43 -27.94 67.88 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 124.967 1.307 . . . . 0.0 114.387 172.299 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -75.62 -14.54 60.38 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.289 0.95 . . . . 0.0 113.086 175.536 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 34.2 m -61.63 141.34 57.86 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 120.231 1.378 . . . . 0.0 111.65 177.385 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 150.41 -169.67 30.34 Favored Glycine 0 N--CA 1.473 1.138 0 C-N-CA 124.377 0.989 . . . . 0.0 113.345 -176.997 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.3 m -94.88 142.45 27.45 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.271 1.028 . . . . 0.0 110.517 -178.057 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -138.82 162.51 34.58 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.137 1.775 . . . . 0.0 111.71 -179.144 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -161.75 157.56 24.46 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.578 1.551 . . . . 0.0 111.783 174.183 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 25.9 p -104.68 151.73 23.35 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.456 0.702 . . . . 0.0 111.754 168.834 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -148.47 133.05 4.41 Favored Glycine 0 N--CA 1.471 0.986 0 C-N-CA 124.709 1.147 . . . . 0.0 112.784 -177.836 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -110.57 156.02 21.51 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -176.175 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 19.7 tt -137.89 136.13 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 125.698 1.599 . . . . 0.0 109.921 174.026 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 14.4 t -62.77 157.52 20.97 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.774 0.83 . . . . 0.0 112.953 176.935 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.49 -9.65 50.31 Favored 'General case' 0 CA--C 1.546 0.827 0 N-CA-C 114.274 1.213 . . . . 0.0 114.274 169.95 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -68.56 149.18 98.07 Favored Pre-proline 0 CA--C 1.553 1.078 0 C-N-CA 124.341 1.056 . . . . 0.0 112.428 178.592 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -69.32 -26.13 29.93 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 122.951 2.434 . . . . 0.0 112.812 178.853 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.8 ptmt -86.04 5.22 34.51 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.218 1.407 . . . . 0.0 114.581 178.055 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.41 163.17 18.87 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.799 1.24 . . . . 0.0 114.214 -173.335 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.96 157.25 43.42 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 126.308 1.843 . . . . 0.0 108.648 176.875 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 61.7 mt -78.31 124.38 36.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 123.861 0.865 . . . . 0.0 111.269 -174.482 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 24.1 tptp -94.55 126.93 40.15 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.297 1.439 . . . . 0.0 109.613 168.839 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -84.38 157.02 21.57 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.293 1.037 . . . . 0.0 112.059 175.237 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 97.0 p -108.33 -166.13 1.1 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 125.241 1.416 . . . . 0.0 111.099 168.128 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 11.1 mp -63.16 151.02 41.41 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.347 1.059 . . . . 0.0 111.715 172.661 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -90.69 142.74 27.45 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.075 0.95 . . . . 0.0 109.985 171.542 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -135.0 152.93 52.18 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 125.322 1.449 . . . . 0.0 111.809 178.74 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -104.51 138.87 40.24 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.661 1.184 . . . . 0.0 111.687 -177.9 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 50.9 tp -108.81 129.28 55.39 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 125.905 1.682 . . . . 0.0 109.202 169.348 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 60.6 ttt85 -121.69 120.22 34.07 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.795 1.638 . . . . 0.0 109.71 173.664 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 39.1 t -104.22 118.91 52.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 124.177 0.991 . . . . 0.0 109.045 171.626 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 67.4 p -98.74 154.77 17.74 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 126.114 1.766 . . . . 0.0 110.459 178.266 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -65.85 144.78 56.61 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.674 -0.641 . . . . 0.0 112.21 -177.367 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 35.9 ttt85 . . . . . 0 N--CA 1.467 0.411 0 C-N-CA 124.577 1.151 . . . . 0.0 109.862 179.169 . . . . . . . . 0 0 . 1 . 032 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.7 t . . . . . 0 N--CA 1.47 0.565 0 N-CA-C 112.802 0.668 . . . . 0.0 112.802 . . . . . . . . . 0 0 . 1 . 032 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 82.9 t80 -149.05 117.46 6.49 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.593 2.357 . . . . 0.0 108.647 -176.603 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 91.8 p -140.96 159.35 62.36 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 124.554 1.142 . . . . 0.0 113.558 -169.032 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -70.35 164.98 79.55 Favored 'Cis proline' 0 C--N 1.355 0.893 0 CA-C-N 119.987 1.031 . . . . 0.0 112.221 -2.535 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.05 -24.94 68.15 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 175.573 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 40.2 tp -143.55 119.03 10.32 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 125.772 1.629 . . . . 0.0 108.855 169.847 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 56.6 tp -102.1 124.39 47.63 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.656 1.182 . . . . 0.0 108.859 169.536 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.8 t -110.17 124.51 66.98 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 172.756 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 30.5 m -126.06 163.56 27.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 C-N-CA 124.388 1.075 . . . . 0.0 111.781 172.398 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 35.1 m -92.53 144.95 24.83 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.031 0.932 . . . . 0.0 109.863 171.836 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -49.65 124.59 9.86 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.333 1.453 . . . . 0.0 112.579 -179.262 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 91.52 -3.89 79.26 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 126.052 1.787 . . . . 0.0 114.818 -177.415 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -84.75 157.64 20.97 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.585 1.692 . . . . 0.0 112.088 174.929 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -83.61 117.65 23.3 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.84 0.856 . . . . 0.0 110.478 175.64 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -97.83 114.46 26.51 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.152 0.981 . . . . 0.0 111.134 -177.3 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 30.5 m -117.56 126.5 52.68 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.758 0.823 . . . . 0.0 111.793 -177.164 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -100.89 159.51 15.14 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.527 1.931 . . . . 0.0 109.969 169.385 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 93.3 m -102.36 139.16 38.33 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.346 1.458 . . . . 0.0 108.699 169.669 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 46.8 t -130.35 146.33 51.92 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.707 1.203 . . . . 0.0 111.234 171.062 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 16.0 t -149.54 133.62 17.18 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 121.347 -0.846 . . . . 0.0 111.342 179.044 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 18.5 m-85 . . . . . 0 N--CA 1.467 0.41 0 C-N-CA 127.779 2.432 . . . . 0.0 111.69 -179.103 . . . . . . . . 0 0 . 1 . 032 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 44.9 p90 . . . . . 0 CA--C 1.543 0.678 0 N-CA-C 111.437 0.162 . . . . 0.0 111.437 . . . . . . . . . 0 0 . 1 . 032 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 22.4 t -96.0 128.04 47.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 171.05 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 18.8 tp -105.12 139.11 40.28 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.911 0.884 . . . . 0.0 110.072 171.726 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 14.8 m-80 -132.94 150.38 52.16 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.582 1.553 . . . . 0.0 110.644 -169.698 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 9.4 t90 -121.71 137.55 54.71 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.201 1.0 . . . . 0.0 111.758 -178.493 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -134.07 144.32 48.56 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.565 1.146 . . . . 0.0 113.155 -175.434 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -104.89 140.08 38.68 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.028 1.331 . . . . 0.0 108.438 168.251 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 27.2 mtp -87.12 141.82 28.38 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 118.717 0.69 . . . . 0.0 111.956 178.879 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 50.2 m -92.81 157.98 38.64 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 124.888 1.275 . . . . 0.0 111.919 176.562 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_exo -55.73 -33.8 88.82 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 123.919 3.079 . . . . 0.0 114.113 176.48 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.7 m -77.03 9.55 2.91 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.182 1.393 . . . . 0.0 113.768 176.932 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 26.8 m120 70.42 20.9 5.85 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 127.336 2.254 . . . . 0.0 113.359 -179.016 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -89.99 -173.73 3.98 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.482 1.113 . . . . 0.0 110.549 170.555 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.9 p -144.15 145.93 32.43 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.779 1.632 . . . . 0.0 110.507 -175.635 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -123.15 132.4 54.06 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.648 1.179 . . . . 0.0 111.192 175.243 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -79.01 126.87 31.26 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.921 0.888 . . . . 0.0 111.382 -177.892 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 59.4 mt -99.75 -45.15 5.84 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.984 1.313 . . . . 0.0 112.472 -169.968 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -173.99 175.9 2.69 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.713 2.405 . . . . 0.0 110.282 -174.102 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.55 168.83 25.19 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.206 1.403 . . . . 0.0 112.379 -178.544 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -144.66 122.29 6.53 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 125.64 1.576 . . . . 0.0 110.042 169.481 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo . . . . . 0 C--N 1.352 0.759 0 CA-C-N 120.435 1.191 . . . . 0.0 112.582 -9.319 . . . . . . . . 0 0 . 1 . 032 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 44.5 mtp-105 . . . . . 0 N--CA 1.474 0.774 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 . . . . . . . . . 0 0 . 1 . 032 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -92.03 127.88 37.67 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.922 1.289 . . . . 0.0 109.736 175.625 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -131.15 144.16 51.17 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.19 1.396 . . . . 0.0 110.804 -175.867 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 47.8 t -126.57 128.28 71.05 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 124.846 1.258 . . . . 0.0 108.986 176.478 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 88.5 m -125.98 132.31 52.07 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.82 1.248 . . . . 0.0 110.287 -176.939 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -88.13 137.94 31.88 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.024 0.929 . . . . 0.0 110.407 172.735 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 44.2 mt -87.47 158.7 51.31 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 124.745 1.218 . . . . 0.0 111.433 177.669 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -65.42 -2.71 6.46 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 123.529 2.819 . . . . 0.0 114.293 175.85 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -63.52 -26.08 68.54 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 119.643 1.11 . . . . 0.0 112.861 169.735 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 98.61 -22.22 42.05 Favored Glycine 0 N--CA 1.476 1.308 0 C-N-CA 125.696 1.617 . . . . 0.0 114.273 174.579 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -154.48 73.65 0.92 Allowed 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.519 1.528 . . . . 0.0 110.166 169.381 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 17.9 t0 -163.56 141.48 7.6 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 128.919 2.888 . . . . 0.0 106.819 178.486 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -146.42 155.75 42.8 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 -167.188 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 56.7 m170 -116.15 147.61 41.19 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 126.043 1.737 . . . . 0.0 110.955 168.502 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 33.3 mtt -132.94 112.96 12.3 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.622 1.569 . . . . 0.0 109.381 -178.009 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 68.0 m -118.41 126.21 51.59 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 -167.561 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 19.7 t -90.53 108.35 19.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 167.653 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 88.7 t -70.55 125.74 29.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 123.727 0.811 . . . . 0.0 109.389 176.325 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 39.2 ttm180 54.64 63.83 2.01 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.108 1.363 . . . . 0.0 111.035 172.241 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -70.38 137.36 50.44 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.554 0.742 . . . . 0.0 111.476 -171.427 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -114.66 163.44 15.44 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.818 1.647 . . . . 0.0 110.62 -179.542 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 88.1 mtm-85 -52.88 -34.96 57.08 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.867 0.867 . . . . 0.0 112.858 -175.501 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 39.5 t30 -66.13 -16.42 63.94 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.857 1.663 . . . . 0.0 115.238 176.216 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -80.28 -14.1 58.66 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 120.305 1.411 . . . . 0.0 112.989 176.312 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 20.2 m -62.74 138.79 58.6 Favored 'General case' 0 CA--C 1.546 0.806 0 O-C-N 121.015 -1.053 . . . . 0.0 112.706 -177.543 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 150.74 -163.87 29.77 Favored Glycine 0 N--CA 1.472 1.059 0 C-N-CA 124.505 1.05 . . . . 0.0 113.293 -177.762 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.8 m -92.53 138.89 31.12 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.484 1.114 . . . . 0.0 111.277 -177.213 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -134.24 160.43 37.89 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.43 1.892 . . . . 0.0 111.395 178.218 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -157.24 158.13 35.59 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.864 1.266 . . . . 0.0 112.64 173.096 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 45.5 t -109.41 147.61 32.51 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.865 1.666 . . . . 0.0 111.033 -178.68 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -150.66 142.13 9.32 Favored Glycine 0 N--CA 1.471 0.997 0 N-CA-C 114.63 0.612 . . . . 0.0 114.63 179.272 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -115.82 159.25 21.73 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.14 1.376 . . . . 0.0 113.684 -173.933 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 19.9 tt -155.95 136.36 4.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 125.723 1.609 . . . . 0.0 110.568 173.848 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 18.2 m -65.81 161.31 21.25 Favored 'General case' 0 N--CA 1.475 0.787 0 O-C-N 121.282 -0.886 . . . . 0.0 113.115 179.927 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 56.6 mt -70.06 -20.6 63.22 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.731 1.012 . . . . 0.0 113.731 -177.882 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -70.37 146.09 93.87 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 124.35 1.06 . . . . 0.0 112.253 177.4 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -69.65 -16.6 38.1 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 123.296 2.664 . . . . 0.0 113.273 -179.653 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 47.5 mmtm -79.95 -0.27 34.44 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.78 1.232 . . . . 0.0 114.142 177.114 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -77.05 165.22 24.91 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 125.633 1.573 . . . . 0.0 113.78 -178.093 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 27.4 mp0 -138.59 155.83 48.0 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.902 1.681 . . . . 0.0 109.719 174.262 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 32.0 mm -60.48 137.11 23.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 124.421 1.088 . . . . 0.0 111.158 177.879 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.12 137.2 54.91 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.983 1.713 . . . . 0.0 109.54 169.585 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -113.94 153.7 28.83 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.27 1.028 . . . . 0.0 112.863 -169.424 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 80.2 p -104.44 173.31 6.36 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.655 1.582 . . . . 0.0 112.914 174.717 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.83 122.81 18.51 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.532 1.133 . . . . 0.0 110.88 174.416 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.73 151.26 45.59 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.14 0.976 . . . . 0.0 113.227 179.662 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -143.0 164.81 29.06 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.52 1.528 . . . . 0.0 112.913 -178.486 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -102.78 143.13 32.81 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.267 1.427 . . . . 0.0 112.834 -172.737 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 60.7 tp -114.79 132.13 56.57 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 126.343 1.857 . . . . 0.0 108.542 168.075 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 61.9 ttm-85 -126.01 120.22 29.72 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.284 1.433 . . . . 0.0 109.908 174.098 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 41.2 t -104.36 113.09 40.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 124.355 1.062 . . . . 0.0 108.623 170.507 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 71.2 p -93.01 145.31 24.47 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.342 1.457 . . . . 0.0 109.858 178.925 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -66.64 144.91 56.11 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 121.431 0.634 . . . . 0.0 111.959 -178.212 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 55.8 ttm-85 . . . . . 0 N--CA 1.467 0.384 0 C-N-CA 123.878 0.871 . . . . 0.0 110.337 -176.622 . . . . . . . . 0 0 . 1 . 033 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 27.5 m . . . . . 0 N--CA 1.471 0.6 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 . . . . . . . . . 0 0 . 1 . 033 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 43.9 t80 -149.01 121.39 8.45 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.677 1.191 . . . . 0.0 110.484 -176.576 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 58.7 m -140.87 159.89 60.53 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 124.489 1.115 . . . . 0.0 113.026 -169.344 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -70.02 158.85 91.37 Favored 'Cis proline' 0 C--N 1.353 0.807 0 CA-C-N 119.88 0.993 . . . . 0.0 111.482 -5.168 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.56 -30.99 69.02 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 174.476 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 33.4 tp -134.93 123.08 22.83 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 125.44 1.496 . . . . 0.0 108.932 170.403 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 54.7 tp -108.37 124.84 50.99 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.736 1.214 . . . . 0.0 109.256 170.524 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 18.8 t -109.76 124.31 66.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 C-N-CA 123.935 0.894 . . . . 0.0 108.898 173.566 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.6 m -127.64 169.83 18.43 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 C-N-CA 124.897 1.279 . . . . 0.0 111.355 171.924 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 89.5 m -100.0 147.86 25.15 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.771 1.229 . . . . 0.0 110.244 174.757 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -55.32 119.1 5.06 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.676 1.19 . . . . 0.0 112.159 179.808 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.87 -1.16 63.16 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 126.301 1.905 . . . . 0.0 114.709 -176.911 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -90.93 153.73 19.98 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 119.275 1.538 . . . . 0.0 110.924 171.245 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -80.79 139.91 35.77 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 121.875 0.845 . . . . 0.0 111.519 171.919 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -114.65 130.27 56.78 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.246 1.818 . . . . 0.0 110.545 -178.664 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 30.9 m -132.7 124.6 28.49 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.71 0.804 . . . . 0.0 111.618 -176.552 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -101.59 159.57 15.19 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.032 1.733 . . . . 0.0 110.299 169.469 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 25.9 m -112.66 132.02 55.37 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.368 1.467 . . . . 0.0 110.067 175.057 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 35.3 t -114.39 140.82 48.36 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.572 1.549 . . . . 0.0 112.08 171.899 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 17.2 m -134.13 131.85 39.19 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.967 1.707 . . . . 0.0 108.305 176.036 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 42.4 p90 . . . . . 0 N--CA 1.474 0.772 0 CA-C-N 119.919 1.236 . . . . 0.0 113.558 -169.179 . . . . . . . . 0 0 . 1 . 033 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 55.9 p90 . . . . . 0 CA--C 1.537 0.458 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 . . . . . . . . . 0 0 . 1 . 033 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 62.4 t -107.14 124.2 62.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 125.5 1.52 . . . . 0.0 107.08 167.681 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -99.4 140.78 33.07 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.454 1.502 . . . . 0.0 108.014 170.701 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -136.68 149.42 47.91 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.502 1.521 . . . . 0.0 111.171 175.331 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 22.0 t90 -124.55 138.36 54.33 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.525 1.13 . . . . 0.0 110.73 174.602 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -132.47 147.94 52.38 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 -170.939 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.9 ttt180 -109.26 141.34 41.69 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.792 1.637 . . . . 0.0 108.355 167.242 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 36.2 mtp -86.42 145.89 26.66 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 118.944 0.793 . . . . 0.0 112.462 176.301 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.1 p -88.88 165.2 28.34 Favored Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 123.89 0.876 . . . . 0.0 112.662 174.162 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -58.82 -28.98 88.65 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 123.636 2.891 . . . . 0.0 113.433 170.594 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.4 m -80.36 1.78 27.49 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.896 1.279 . . . . 0.0 113.265 175.939 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 73.61 21.09 2.92 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 127.588 2.355 . . . . 0.0 113.213 -179.649 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -88.38 -172.67 3.87 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.622 0.769 . . . . 0.0 109.575 169.483 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.3 p -140.59 142.86 35.04 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.376 1.47 . . . . 0.0 110.804 -174.84 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -122.86 131.53 53.79 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.505 1.122 . . . . 0.0 110.922 175.442 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 20.8 ttmt -71.9 137.74 47.65 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.873 0.869 . . . . 0.0 110.632 178.385 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 52.8 mt -114.61 -45.99 2.98 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.936 1.695 . . . . 0.0 111.975 -171.944 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -156.51 168.62 26.82 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 126.281 1.832 . . . . 0.0 109.689 179.683 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -156.62 163.68 39.05 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.348 1.059 . . . . 0.0 111.955 -174.801 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -149.2 110.35 3.46 Favored Pre-proline 0 CA--C 1.547 0.835 0 CA-C-O 118.024 -0.988 . . . . 0.0 110.676 174.646 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo . . . . . 0 C--N 1.352 0.734 0 CA-C-N 120.64 1.264 . . . . 0.0 113.623 -4.794 . . . . . . . . 0 0 . 1 . 033 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 44.6 mtp180 . . . . . 0 N--CA 1.472 0.66 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 . . . . . . . . . 0 0 . 1 . 033 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 -95.01 137.48 34.0 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.937 1.295 . . . . 0.0 111.079 178.43 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 30.0 ttp180 -144.46 151.61 39.43 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.234 1.014 . . . . 0.0 111.925 177.421 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -122.79 133.83 67.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 124.962 1.305 . . . . 0.0 110.753 168.869 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.1 m -130.5 130.01 43.63 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.098 1.359 . . . . 0.0 109.871 -173.247 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -79.4 136.38 36.95 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 118.736 0.698 . . . . 0.0 110.778 178.549 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 7.0 mt -79.79 159.9 70.39 Favored Pre-proline 0 CA--C 1.544 0.715 0 CA-C-O 118.92 -0.562 . . . . 0.0 111.652 177.773 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -62.85 -16.74 55.65 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 123.135 2.556 . . . . 0.0 113.646 170.996 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -66.11 -26.06 67.28 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 119.231 0.923 . . . . 0.0 112.439 169.793 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 86.21 -34.11 3.49 Favored Glycine 0 N--CA 1.472 1.066 0 C-N-CA 126.836 2.16 . . . . 0.0 114.393 169.881 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 -111.53 73.65 0.83 Allowed 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.594 1.158 . . . . 0.0 108.194 169.41 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 175.36 141.3 0.05 Allowed 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 128.388 2.675 . . . . 0.0 109.739 -170.606 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -142.33 150.22 40.48 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.453 1.101 . . . . 0.0 112.37 178.931 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 18.2 m170 -98.82 139.24 34.79 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.329 1.452 . . . . 0.0 110.229 167.003 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -115.11 113.07 23.52 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 126.761 2.024 . . . . 0.0 108.058 175.961 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 17.8 m -118.76 128.44 54.49 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 114.331 1.234 . . . . 0.0 114.331 -167.338 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 36.6 t -99.24 117.56 44.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 125.869 1.668 . . . . 0.0 106.947 167.528 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 97.2 t -83.09 126.33 40.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 123.893 0.877 . . . . 0.0 109.96 174.577 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 85.5 mtt85 54.21 66.55 1.2 Allowed 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 126.11 1.764 . . . . 0.0 111.624 176.963 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.96 136.43 53.92 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.487 1.115 . . . . 0.0 111.308 -176.87 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -118.26 165.64 13.57 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 126.9 2.08 . . . . 0.0 110.462 -178.262 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 26.3 mmm180 -52.52 -28.73 21.83 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.348 1.059 . . . . 0.0 113.054 178.231 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -63.66 -24.22 67.7 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 125.66 1.584 . . . . 0.0 114.825 173.228 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -86.08 -17.88 33.9 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 120.147 1.34 . . . . 0.0 113.682 -176.992 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 49.3 m -57.71 133.86 55.72 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 120.779 -1.2 . . . . 0.0 112.681 -178.742 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 153.39 -167.46 31.91 Favored Glycine 0 N--CA 1.473 1.152 0 C-N-CA 124.253 0.93 . . . . 0.0 113.788 -176.073 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.2 m -91.1 143.05 27.1 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 125.162 1.385 . . . . 0.0 110.825 -175.861 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -139.94 157.55 45.5 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 126.462 1.905 . . . . 0.0 111.551 -177.796 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -156.94 149.31 23.18 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.324 1.05 . . . . 0.0 113.269 173.011 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 44.3 t -89.63 152.98 21.1 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.35 1.86 . . . . 0.0 110.884 172.057 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -160.05 141.63 7.6 Favored Glycine 0 N--CA 1.47 0.936 0 O-C-N 121.469 -0.769 . . . . 0.0 113.207 170.214 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -138.13 158.59 44.01 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 118.259 1.029 . . . . 0.0 113.154 -177.419 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 16.7 tt -147.27 134.62 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 C-N-CA 125.364 1.466 . . . . 0.0 110.097 -178.951 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 65.7 m -76.17 158.48 31.65 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 121.62 -0.675 . . . . 0.0 111.795 176.994 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 28.3 mt -73.92 -10.01 59.22 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 -177.264 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.81 143.06 94.53 Favored Pre-proline 0 CA--C 1.551 1.012 0 C-N-CA 124.104 0.962 . . . . 0.0 111.816 173.738 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -67.72 -19.83 47.05 Favored 'Trans proline' 0 CA--C 1.538 0.675 0 C-N-CA 123.313 2.676 . . . . 0.0 113.35 -176.943 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 23.3 ttpp -83.7 -0.39 50.56 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 124.92 1.288 . . . . 0.0 113.572 177.459 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -74.87 149.75 39.43 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.364 1.066 . . . . 0.0 113.39 -178.277 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -128.89 158.29 39.19 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.925 2.09 . . . . 0.0 107.764 169.991 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 35.1 mt -70.94 114.9 9.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 O-C-N 121.487 -0.758 . . . . 0.0 110.43 -179.072 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -77.85 88.51 4.06 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.32 1.448 . . . . 0.0 108.792 169.629 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -78.65 133.71 37.21 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.129 0.972 . . . . 0.0 110.394 176.898 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 45.0 m -83.68 175.53 9.64 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.396 1.078 . . . . 0.0 113.225 179.669 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 84.5 mt -58.56 147.49 32.03 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.188 0.995 . . . . 0.0 111.563 171.682 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -75.51 132.29 40.65 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 123.369 0.668 . . . . 0.0 110.561 173.839 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.9 169.65 9.07 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 126.268 1.827 . . . . 0.0 109.877 170.06 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -133.98 145.09 49.19 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 122.027 0.917 . . . . 0.0 113.021 173.271 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 68.0 tp -103.66 135.11 45.85 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 127.081 2.152 . . . . 0.0 109.687 176.233 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 60.7 ttt85 -125.27 118.09 25.22 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.731 1.612 . . . . 0.0 109.858 172.425 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 53.2 t -98.4 118.81 45.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 C-N-CA 124.062 0.945 . . . . 0.0 108.573 169.057 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 81.7 p -91.53 149.81 21.5 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.411 1.485 . . . . 0.0 109.999 173.438 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -63.16 147.09 51.87 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.276 0.56 . . . . 0.0 112.035 -179.028 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 27.5 ttm180 . . . . . 0 C--O 1.237 0.402 0 C-N-CA 123.805 0.842 . . . . 0.0 109.93 -176.072 . . . . . . . . 0 0 . 1 . 034 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 32.1 p . . . . . 0 N--CA 1.479 1.008 0 CA-C-O 120.119 0.009 . . . . 0.0 110.994 . . . . . . . . . 0 0 . 1 . 034 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.408 ' CE1' ' HB2' ' A' ' 123' ' ' CYS . 3.9 m-85 -121.86 135.67 54.9 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.004 1.322 . . . . 0.0 110.557 175.328 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 95.1 p -140.98 159.04 63.48 Favored Pre-proline 0 CA--C 1.549 0.921 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 173.31 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -72.7 163.72 88.0 Favored 'Cis proline' 0 C--N 1.352 0.737 0 CA-C-N 119.186 0.745 . . . . 0.0 111.411 -11.376 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.7 -33.9 74.82 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 170.432 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 51.7 tp -138.93 123.57 18.53 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.594 1.557 . . . . 0.0 109.269 171.563 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 51.6 tp -105.14 130.78 53.23 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.259 1.424 . . . . 0.0 109.341 170.755 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.4 t -112.06 126.55 69.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.987 0.915 . . . . 0.0 108.658 170.607 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.3 m -129.56 165.98 28.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 124.545 1.138 . . . . 0.0 111.933 173.079 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 20.0 m -86.3 146.5 26.48 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.178 0.991 . . . . 0.0 110.138 169.573 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 58.1 tt0 -55.32 123.59 14.3 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.042 1.337 . . . . 0.0 110.799 173.02 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.0 -0.5 72.77 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 125.5 1.524 . . . . 0.0 114.861 -174.334 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -95.43 158.08 15.61 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 119.644 1.722 . . . . 0.0 112.274 174.522 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 -83.11 116.58 22.39 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.073 0.949 . . . . 0.0 110.747 -179.866 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -98.47 116.12 30.01 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.292 1.037 . . . . 0.0 111.147 -179.793 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 57.1 m -125.28 125.45 43.55 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 118.718 0.69 . . . . 0.0 111.896 -174.609 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -101.06 146.72 27.07 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 126.371 1.868 . . . . 0.0 110.689 171.989 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 31.5 m -93.95 129.34 40.45 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.042 1.337 . . . . 0.0 108.813 171.199 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 69.8 m -130.3 130.24 44.25 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.398 1.079 . . . . 0.0 110.654 172.252 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 68.5 m -117.44 143.4 46.05 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.339 1.456 . . . . 0.0 110.687 -176.316 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 . . . . . 0 N--CA 1.468 0.446 0 C-N-CA 125.248 1.419 . . . . 0.0 113.475 -172.841 . . . . . . . . 0 0 . 1 . 034 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 50.3 p90 . . . . . 0 CA--C 1.54 0.559 0 CA-C-O 120.477 0.179 . . . . 0.0 111.461 . . . . . . . . . 0 0 . 1 . 034 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 77.4 t -95.93 127.98 47.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 172.263 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 61.3 tp -106.54 136.16 46.79 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 125.217 1.407 . . . . 0.0 109.751 173.618 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -132.43 153.8 50.48 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.282 1.833 . . . . 0.0 110.528 179.151 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 15.0 t90 -123.52 139.82 53.63 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.659 1.184 . . . . 0.0 111.118 176.081 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 64.4 m-85 -134.28 143.7 47.91 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 114.516 1.302 . . . . 0.0 114.516 -170.824 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 56.9 ttt85 -102.19 143.01 32.53 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.575 1.55 . . . . 0.0 109.229 168.406 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 86.3 mmm -77.46 133.04 38.71 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 118.466 0.575 . . . . 0.0 111.463 174.319 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.5 p -82.45 166.22 37.73 Favored Pre-proline 0 CA--C 1.549 0.914 0 O-C-N 121.557 -0.715 . . . . 0.0 112.555 173.669 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -58.32 -27.99 83.08 Favored 'Trans proline' 0 C--N 1.354 0.856 0 C-N-CA 123.475 2.784 . . . . 0.0 113.662 170.267 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 31.3 m -83.92 2.94 36.21 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.985 1.314 . . . . 0.0 113.189 175.424 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 69.55 26.68 5.02 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 126.721 2.008 . . . . 0.0 112.639 -178.758 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -92.23 -177.47 4.67 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.083 0.953 . . . . 0.0 109.743 169.606 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 8.7 p -127.48 122.51 33.64 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.574 1.55 . . . . 0.0 109.582 -171.981 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -108.22 126.35 52.7 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 124.288 1.035 . . . . 0.0 110.976 -178.094 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -79.22 120.53 23.84 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.632 1.173 . . . . 0.0 111.98 -170.809 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 42.4 mt -97.88 -49.38 4.82 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.654 1.582 . . . . 0.0 111.991 -170.139 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -162.56 169.17 20.68 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.438 1.895 . . . . 0.0 110.145 -173.12 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -157.22 162.65 39.27 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.451 1.101 . . . . 0.0 112.928 -170.155 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -152.32 113.5 2.85 Favored Pre-proline 0 CA--C 1.552 1.038 0 C-N-CA 125.379 1.472 . . . . 0.0 111.114 174.547 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo . . . . . 0 CA--C 1.538 0.686 0 CA-C-N 119.653 0.912 . . . . 0.0 110.287 -12.041 . . . . . . . . 0 0 . 1 . 034 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 60.6 mtm-85 . . . . . 0 N--CA 1.471 0.608 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 . . . . . . . . . 0 0 . 1 . 034 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 84.4 m-85 -69.48 130.68 43.16 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.473 1.509 . . . . 0.0 112.026 -179.045 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 31.8 ttp-105 -144.39 141.29 29.57 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 126.041 1.737 . . . . 0.0 111.079 -176.841 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 57.9 t -108.46 127.81 64.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 C-N-CA 125.089 1.356 . . . . 0.0 108.678 169.502 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 6.0 m -123.32 138.65 54.57 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.633 1.573 . . . . 0.0 109.428 -176.323 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.16 141.79 34.44 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.108 0.963 . . . . 0.0 112.679 179.373 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.449 HD23 ' HA ' ' A' ' 106' ' ' PHE . 0.9 OUTLIER -96.76 158.72 33.08 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 126.079 1.752 . . . . 0.0 111.169 -174.75 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -66.98 -11.28 31.64 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 123.627 2.884 . . . . 0.0 114.224 -178.993 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -66.56 -18.25 65.26 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 119.197 0.908 . . . . 0.0 113.248 172.203 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 88.83 -14.69 59.57 Favored Glycine 0 CA--C 1.535 1.3 0 C-N-CA 125.496 1.522 . . . . 0.0 115.323 175.492 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.4 ptp180 -154.51 73.53 0.91 Allowed 'General case' 0 N--CA 1.473 0.694 0 CA-C-O 122.972 1.367 . . . . 0.0 110.581 171.585 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -165.04 143.87 6.59 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 129.254 3.022 . . . . 0.0 106.684 -179.657 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 106' ' ' PHE . . . . . 0.449 ' HA ' HD23 ' A' ' 100' ' ' LEU . 52.0 m-85 -145.32 145.2 31.13 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -167.54 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 7.3 m-70 -109.1 117.6 34.58 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.539 1.536 . . . . 0.0 110.859 170.118 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -100.47 111.16 23.38 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 125.768 1.627 . . . . 0.0 108.206 177.855 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 13.6 t -120.12 130.09 54.46 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 -168.061 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 12.1 t -97.45 100.25 10.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 125.696 1.598 . . . . 0.0 107.045 168.444 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 95.4 t -66.83 130.8 32.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 123.662 0.785 . . . . 0.0 109.907 178.191 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . 0.265 14.6 ptm180 39.7 61.16 1.48 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 127.516 2.326 . . . . 0.0 113.94 -177.123 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.76 140.01 57.71 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.403 1.481 . . . . 0.0 112.605 -171.731 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -104.61 162.02 13.63 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.355 1.462 . . . . 0.0 110.866 -179.478 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 16.4 mmm180 -47.48 -41.12 20.0 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.471 1.108 . . . . 0.0 113.015 178.043 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -65.27 -21.56 66.74 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 125.349 1.46 . . . . 0.0 114.832 177.657 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -75.8 -12.24 60.13 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 119.133 0.879 . . . . 0.0 112.532 176.993 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.5 m -59.09 139.53 56.78 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 120.634 -1.291 . . . . 0.0 111.609 171.794 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 154.76 -168.28 32.79 Favored Glycine 0 N--CA 1.468 0.771 0 C-N-CA 123.927 0.775 . . . . 0.0 113.313 179.428 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.1 m -95.5 144.23 26.16 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.934 1.294 . . . . 0.0 110.191 -179.115 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 -142.82 162.95 34.11 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.605 1.562 . . . . 0.0 112.488 -175.143 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.1 pp -153.48 148.39 26.57 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.845 1.258 . . . . 0.0 111.984 169.154 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 123' ' ' CYS . . . . . 0.408 ' HB2' ' CE1' ' A' ' 37' ' ' PHE . 71.0 m -90.24 153.1 20.74 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.701 1.2 . . . . 0.0 109.652 169.383 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -152.95 134.1 4.31 Favored Glycine 0 N--CA 1.471 1.026 0 O-C-N 121.225 -0.922 . . . . 0.0 113.373 176.45 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -119.75 157.57 28.32 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.347 1.059 . . . . 0.0 112.417 -178.856 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.0 tt -151.41 132.17 4.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 124.868 1.267 . . . . 0.0 110.77 177.939 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 44.9 t -65.21 157.82 27.81 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.894 0.877 . . . . 0.0 112.819 178.251 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 3.8 pp -71.51 -9.48 58.27 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 175.024 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -66.5 146.09 99.02 Favored Pre-proline 0 CA--C 1.552 1.023 0 C-N-CA 124.318 1.047 . . . . 0.0 112.057 175.948 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -68.75 -24.6 34.49 Favored 'Trans proline' 0 CA--C 1.539 0.736 0 C-N-CA 123.092 2.528 . . . . 0.0 113.023 -178.746 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.6 ptmt -83.16 1.37 40.87 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 177.827 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.04 163.75 21.66 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.525 1.13 . . . . 0.0 113.751 -174.837 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 22.3 pt20 -149.68 163.07 38.94 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.53 1.932 . . . . 0.0 109.31 175.32 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 67.1 mt -73.13 119.27 19.74 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 CA-C-O 121.799 0.809 . . . . 0.0 111.174 -173.65 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 25.2 ttmt -88.08 124.73 34.07 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 126.857 2.063 . . . . 0.0 109.536 169.688 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -147.72 158.72 44.15 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.266 1.426 . . . . 0.0 111.292 -179.036 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 17.9 m -117.46 -173.54 2.44 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.674 1.59 . . . . 0.0 111.913 179.855 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 98.5 mt -60.02 143.25 52.33 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.125 0.97 . . . . 0.0 111.836 176.533 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 91.8 mtm-85 -66.52 153.35 43.17 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.91 1.284 . . . . 0.0 113.388 -172.619 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.89 162.56 17.15 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.567 1.947 . . . . 0.0 110.811 175.675 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -130.16 142.74 50.56 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.604 1.162 . . . . 0.0 111.618 -177.2 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 50.9 tp -116.09 133.89 55.54 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 125.978 1.711 . . . . 0.0 110.082 173.41 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 43.5 ttm180 -122.36 117.17 25.41 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.881 1.673 . . . . 0.0 109.31 170.427 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 54.4 t -99.99 119.21 47.74 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 N-CA-C 107.861 -1.162 . . . . 0.0 107.861 169.962 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 72.6 p -98.68 139.9 33.7 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.31 1.444 . . . . 0.0 109.422 177.614 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 4.5 pm0 -62.98 146.04 54.02 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.672 0.789 . . . . 0.0 113.119 -173.041 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 42.9 ttt85 . . . . . 0 C--O 1.235 0.341 0 C-N-CA 124.132 0.973 . . . . 0.0 110.338 -170.179 . . . . . . . . 0 0 . 1 . 035 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.8 t . . . . . 0 N--CA 1.473 0.719 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 . . . . . . . . . 0 0 . 1 . 035 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -146.82 118.0 7.81 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.642 1.977 . . . . 0.0 110.007 179.332 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 90.2 p -140.91 163.23 43.92 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 125.027 1.331 . . . . 0.0 113.5 -171.114 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -70.87 165.5 79.6 Favored 'Cis proline' 0 C--N 1.353 0.803 0 CA-C-N 119.932 1.011 . . . . 0.0 111.818 -7.945 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.64 -29.52 70.74 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 172.785 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 51.8 tp -141.31 124.63 16.55 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.65 1.58 . . . . 0.0 109.205 172.356 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 61.3 tp -109.53 126.02 53.12 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.489 1.516 . . . . 0.0 109.012 170.685 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.2 t -110.25 125.14 67.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 123.921 0.888 . . . . 0.0 108.784 173.359 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 33.5 m -130.39 162.8 37.62 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.075 0 C-N-CA 124.667 1.187 . . . . 0.0 112.091 174.053 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 16.5 m -88.36 147.48 24.73 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.533 1.133 . . . . 0.0 110.478 171.874 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -58.61 121.56 11.3 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.884 0.874 . . . . 0.0 112.117 -179.514 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 98.98 -2.94 58.34 Favored Glycine 0 CA--C 1.533 1.162 0 C-N-CA 125.844 1.688 . . . . 0.0 114.54 -173.903 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -87.65 158.16 18.92 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 119.743 1.772 . . . . 0.0 112.443 177.314 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 -77.48 116.04 17.74 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.429 1.092 . . . . 0.0 110.492 170.633 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -102.63 119.62 39.14 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.993 0.917 . . . . 0.0 110.439 178.528 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 54.1 m -128.84 125.37 37.56 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 119.052 0.842 . . . . 0.0 111.711 -175.996 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -98.09 155.69 17.01 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.068 1.747 . . . . 0.0 110.253 169.826 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 56.5 m -107.97 125.7 51.83 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.094 1.358 . . . . 0.0 109.476 177.344 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 16.6 t -118.37 151.64 37.36 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.825 1.25 . . . . 0.0 111.265 170.458 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 24.8 t -147.94 133.28 18.53 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.161 -0.962 . . . . 0.0 111.76 174.186 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 33.2 m-85 . . . . . 0 N--CA 1.468 0.457 0 C-N-CA 127.699 2.399 . . . . 0.0 110.083 170.369 . . . . . . . . 0 0 . 1 . 035 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 24.3 p90 . . . . . 0 CA--C 1.536 0.433 0 N-CA-C 113.959 1.096 . . . . 0.0 113.959 . . . . . . . . . 0 0 . 1 . 035 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 57.3 t -106.37 135.5 44.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 C-N-CA 126.432 1.893 . . . . 0.0 107.662 169.595 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 20.9 tp -104.57 135.96 45.01 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.639 0.775 . . . . 0.0 110.59 171.656 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -127.92 156.06 43.21 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.293 1.437 . . . . 0.0 111.577 -170.035 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 16.2 t90 -129.39 136.03 49.45 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.778 1.231 . . . . 0.0 111.69 -179.607 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -135.84 145.89 46.9 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.399 1.08 . . . . 0.0 112.815 -176.726 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.8 ttt-85 -103.39 141.78 35.36 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.328 1.451 . . . . 0.0 108.85 168.883 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 31.5 mtp -90.29 145.36 25.04 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 118.747 0.703 . . . . 0.0 112.113 178.15 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 70.8 m -95.81 154.86 38.96 Favored Pre-proline 0 CA--C 1.546 0.82 0 C-N-CA 125.175 1.39 . . . . 0.0 111.182 173.526 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -65.44 -23.4 58.2 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 123.175 2.584 . . . . 0.0 113.088 179.435 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 14.6 m -76.96 9.38 2.97 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.087 1.355 . . . . 0.0 113.534 172.398 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . 0.323 0.0 OUTLIER 70.95 20.84 5.19 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 128.891 2.876 . . . . 0.0 114.555 179.545 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -93.66 -174.31 3.43 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.766 1.226 . . . . 0.0 110.949 170.605 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.5 p -144.15 152.56 41.07 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 126.382 1.873 . . . . 0.0 110.317 -175.546 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -128.68 133.15 48.12 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.436 1.094 . . . . 0.0 111.083 172.937 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -78.07 128.3 33.63 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.834 0.854 . . . . 0.0 111.173 -179.95 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 61.4 mt -100.25 -51.02 3.77 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.819 1.248 . . . . 0.0 111.414 -170.342 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -171.09 173.33 5.07 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.582 1.953 . . . . 0.0 110.483 -176.663 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -158.63 161.64 37.2 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.3 1.44 . . . . 0.0 112.077 -176.977 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -141.23 125.5 10.38 Favored Pre-proline 0 CA--C 1.548 0.889 0 C-N-CA 125.148 1.379 . . . . 0.0 110.192 172.549 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo . . . . . 0 C--N 1.351 0.661 0 CA-C-N 120.257 1.128 . . . . 0.0 113.144 -9.025 . . . . . . . . 0 0 . 1 . 035 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 8.8 ptp180 . . . . . 0 N--CA 1.469 0.496 0 N-CA-C 113.666 0.988 . . . . 0.0 113.666 . . . . . . . . . 0 0 . 1 . 035 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -93.35 135.62 34.39 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.165 0.986 . . . . 0.0 111.634 -179.349 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 52.6 mtm180 -139.96 153.12 46.82 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.776 1.23 . . . . 0.0 112.255 177.937 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 63.6 t -126.5 125.55 67.48 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 125.265 1.426 . . . . 0.0 108.094 168.139 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 87.2 m -130.43 126.62 37.46 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.249 1.02 . . . . 0.0 110.235 -178.414 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -80.89 139.87 35.66 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.654 0.781 . . . . 0.0 110.748 174.369 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 16.3 mt -80.85 158.46 70.44 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 124.078 0.951 . . . . 0.0 111.585 177.117 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -65.08 -4.21 8.6 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 123.429 2.752 . . . . 0.0 114.99 179.142 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -70.59 -25.97 63.3 Favored 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 120.562 1.528 . . . . 0.0 112.467 169.908 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 96.58 -3.94 63.6 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 126.214 1.864 . . . . 0.0 114.628 173.701 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 31.2 ptt180 -154.62 73.71 0.91 Allowed 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.937 1.695 . . . . 0.0 110.501 176.17 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -178.02 143.02 0.3 Allowed 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 128.951 2.9 . . . . 0.0 107.905 179.389 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -146.46 136.83 23.82 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.489 0.661 . . . . 0.0 112.757 -168.693 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -98.73 125.55 44.08 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.257 1.423 . . . . 0.0 111.615 170.066 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -104.23 103.24 12.98 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 127.172 2.189 . . . . 0.0 108.39 175.184 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 54.5 p -117.12 132.63 56.62 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 114.842 1.423 . . . . 0.0 114.842 -169.491 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 12.3 t -96.36 111.31 26.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 126.109 1.763 . . . . 0.0 106.961 167.312 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 94.3 t -78.38 127.94 38.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 124.785 1.234 . . . . 0.0 109.302 175.061 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 13.8 tpt180 57.79 54.53 6.14 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.874 1.27 . . . . 0.0 111.092 174.882 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.47 136.85 58.1 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.226 -0.921 . . . . 0.0 113.171 -168.723 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 45.4 mmm-85 -111.38 160.53 16.98 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 125.553 1.541 . . . . 0.0 111.021 -179.248 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 77.3 mtm180 -55.84 -22.59 25.8 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 113.515 0.932 . . . . 0.0 113.515 172.323 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -56.72 -35.51 68.64 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.754 1.621 . . . . 0.0 113.654 168.322 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -83.89 -23.3 31.31 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.862 0.865 . . . . 0.0 112.99 -168.595 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 48.8 m -49.69 139.29 13.03 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.789 1.236 . . . . 0.0 113.119 177.417 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 148.13 -165.87 28.96 Favored Glycine 0 N--CA 1.472 1.033 0 C-N-CA 124.326 0.965 . . . . 0.0 113.359 -176.287 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.2 m -92.35 142.69 27.17 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.982 1.313 . . . . 0.0 110.533 -178.093 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 45.1 m-85 -135.5 161.16 36.27 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.848 1.659 . . . . 0.0 111.91 -179.299 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -148.95 153.28 37.74 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.747 1.219 . . . . 0.0 112.245 172.927 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 49.6 t -101.32 155.4 18.06 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.648 1.579 . . . . 0.0 110.221 169.85 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -163.29 133.6 3.11 Favored Glycine 0 N--CA 1.471 0.999 0 N-CA-C 115.345 0.898 . . . . 0.0 115.345 174.587 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -94.97 157.3 15.96 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.47 1.108 . . . . 0.0 112.76 179.793 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 18.9 tt -152.59 135.41 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 125.065 1.346 . . . . 0.0 110.184 174.673 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 69.7 p -75.53 161.57 29.06 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.68 0.792 . . . . 0.0 113.002 178.2 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.51 -3.39 8.49 Favored 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 115.51 1.67 . . . . 0.0 115.51 178.709 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -73.84 144.18 82.4 Favored Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 124.468 1.107 . . . . 0.0 112.652 -176.306 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -56.53 -32.86 91.14 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 123.362 2.708 . . . . 0.0 113.754 172.502 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.09 4.34 34.61 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 115.046 1.499 . . . . 0.0 115.046 -179.604 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.31 160.32 24.78 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.324 1.05 . . . . 0.0 113.789 -173.833 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -145.34 162.82 36.32 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.821 1.649 . . . . 0.0 110.124 175.017 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 57.8 mt -80.68 119.2 29.78 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 123.62 0.768 . . . . 0.0 111.429 -169.973 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -82.37 93.33 7.16 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.398 1.479 . . . . 0.0 108.303 168.605 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 60.2 mt-10 -79.37 144.49 34.12 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.652 0.781 . . . . 0.0 112.743 -174.658 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 50.2 m -87.37 169.28 12.4 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.814 1.245 . . . . 0.0 113.277 169.776 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 94.2 mt -65.65 150.62 48.16 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.574 0.75 . . . . 0.0 109.888 168.003 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? -76.77 148.23 36.79 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.42 0.688 . . . . 0.0 112.373 -172.531 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -117.95 166.35 12.61 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.429 1.891 . . . . 0.0 110.596 170.093 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -126.36 139.02 53.61 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.656 1.182 . . . . 0.0 111.061 176.84 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 63.7 tp -106.8 131.37 53.99 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.45 1.5 . . . . 0.0 109.531 169.82 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -121.7 109.54 14.85 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.322 1.449 . . . . 0.0 109.199 170.302 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 24.1 t -95.95 114.36 32.48 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 169.979 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 68.9 p -95.73 146.14 24.75 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.452 1.501 . . . . 0.0 109.612 -179.787 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -63.15 148.34 48.26 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 121.627 0.727 . . . . 0.0 112.539 -175.968 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 34.2 ttm180 . . . . . 0 C--O 1.235 0.34 0 C-N-CA 124.156 0.982 . . . . 0.0 110.02 -175.551 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 33' ' ' MET . . . . . 0.49 ' N ' ' HG ' ' A' ' 57' ' ' SER 0.251 66.9 ttp . . . . . 0 N--CA 1.488 1.431 0 CA-C-O 116.594 -1.67 . . . . 0.0 112.595 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -73.36 148.56 43.53 Favored 'Trans proline' 0 CA--C 1.543 0.973 0 CA-C-N 122.548 1.946 . . . . 0.0 112.159 -176.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -74.25 115.08 4.2 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 123.814 3.009 . . . . 0.0 109.333 173.232 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 48.4 m -121.46 150.63 41.27 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.046 1.338 . . . . 0.0 110.063 -169.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -147.0 119.71 8.59 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.894 1.677 . . . . 0.0 109.385 178.026 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 88.3 p -140.85 159.13 63.47 Favored Pre-proline 0 CA--C 1.548 0.904 0 N-CA-C 113.831 1.048 . . . . 0.0 113.831 -168.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -70.06 160.75 88.38 Favored 'Cis proline' 0 C--N 1.355 0.893 0 CA-C-N 119.33 0.796 . . . . 0.0 111.513 -5.633 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.38 -20.52 66.42 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 176.325 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 36.5 tp -141.45 116.89 10.18 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 125.43 1.492 . . . . 0.0 108.819 169.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 61.2 tp -104.71 121.81 44.37 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.282 1.433 . . . . 0.0 108.856 170.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 24.0 t -110.67 122.08 64.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 124.251 1.02 . . . . 0.0 108.311 174.812 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 27.8 m -133.01 167.67 26.1 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 C-N-CA 124.849 1.26 . . . . 0.0 111.777 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.3 m -93.7 150.97 19.97 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.0 1.32 . . . . 0.0 110.66 174.485 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -46.5 125.67 7.24 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.71 1.204 . . . . 0.0 111.703 168.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.96 -1.11 82.93 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 125.906 1.717 . . . . 0.0 114.813 -179.043 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -74.67 151.82 39.22 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 119.801 1.801 . . . . 0.0 112.65 173.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 68.0 m-20 -86.64 88.19 7.61 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.2 1.0 . . . . 0.0 109.188 171.428 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -77.08 114.42 15.86 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.723 0.809 . . . . 0.0 112.351 -167.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 53.0 m -116.27 130.58 56.85 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -171.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -108.57 159.6 16.58 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 127.056 2.142 . . . . 0.0 110.027 168.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 87.9 m -112.97 126.34 55.38 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.375 1.07 . . . . 0.0 110.542 175.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 29.9 m -98.31 148.88 23.2 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.152 0.981 . . . . 0.0 110.215 167.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 39.3 t -139.06 127.4 22.81 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.327 1.051 . . . . 0.0 109.443 172.205 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -134.45 146.27 49.64 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.861 1.264 . . . . 0.0 112.411 -173.089 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.49 ' HG ' ' N ' ' A' ' 33' ' ' MET . 14.2 m -128.14 134.49 49.1 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.572 1.549 . . . . 0.0 109.369 172.827 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -145.01 147.18 32.34 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.816 1.246 . . . . 0.0 111.192 -172.394 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 18.3 p -73.47 -39.85 64.58 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.975 1.31 . . . . 0.0 111.306 171.599 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 17.0 m -60.01 127.95 34.43 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.268 1.827 . . . . 0.0 111.994 173.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -65.21 -28.06 69.12 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.374 1.47 . . . . 0.0 112.864 -178.329 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 67.9 m -138.76 149.33 44.9 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.789 1.636 . . . . 0.0 110.738 176.295 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 52.4 p90 -163.4 162.94 25.14 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.055 1.342 . . . . 0.0 111.836 -173.17 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 45.6 t -95.9 132.89 38.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 125.326 1.45 . . . . 0.0 107.765 169.098 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 10.7 tp -99.41 142.43 30.9 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.418 1.487 . . . . 0.0 108.008 168.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -145.56 158.97 43.77 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.409 1.084 . . . . 0.0 113.191 -176.2 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 16.1 t90 -134.43 141.04 46.68 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.438 1.095 . . . . 0.0 112.512 -170.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -136.92 147.99 46.73 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -172.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 55.5 ttt85 -99.78 129.99 45.94 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 166.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 24.7 tpp -98.49 127.31 44.37 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.258 1.823 . . . . 0.0 109.382 179.299 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 44.9 m -90.84 160.59 37.91 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 125.469 1.508 . . . . 0.0 113.052 -174.279 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -67.44 -18.7 49.53 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 123.263 2.642 . . . . 0.0 112.827 173.024 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 42.5 p -76.92 -3.78 40.5 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.657 1.583 . . . . 0.0 113.367 169.54 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 32.0 m-80 73.77 20.8 2.88 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 128.287 2.635 . . . . 0.0 113.464 179.291 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.3 pp0? -97.75 169.59 9.57 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.818 0.847 . . . . 0.0 111.497 169.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.6 p -130.16 137.34 50.06 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.181 1.393 . . . . 0.0 110.395 -176.021 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -118.65 131.53 56.17 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.825 1.25 . . . . 0.0 111.219 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 76.9 tttt -75.93 132.44 40.26 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.73 1.212 . . . . 0.0 111.323 -175.551 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 76.1 mt -111.48 -47.14 3.2 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.689 1.196 . . . . 0.0 112.435 -170.449 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -167.74 169.72 11.48 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.607 1.563 . . . . 0.0 110.938 -175.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -158.72 159.39 35.19 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.078 1.351 . . . . 0.0 112.501 -177.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -145.78 118.26 5.15 Favored Pre-proline 0 CA--C 1.548 0.9 0 C-N-CA 125.676 1.591 . . . . 0.0 110.866 175.402 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -52.98 159.12 11.1 Favored 'Cis proline' 0 C--N 1.351 0.676 0 CA-C-N 119.997 1.035 . . . . 0.0 112.592 -12.427 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -68.32 94.55 0.54 Allowed 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 122.561 1.172 . . . . 0.0 112.937 -171.03 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -94.64 10.44 34.84 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 127.298 2.239 . . . . 0.0 112.209 173.469 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.24 -14.48 60.79 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.864 1.666 . . . . 0.0 114.435 177.328 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 33.0 t 70.02 -60.96 0.47 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 127.764 2.426 . . . . 0.0 115.291 169.175 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.2 mm-40 -108.01 155.06 40.72 Favored Pre-proline 0 CA--C 1.543 0.681 0 C-N-CA 124.59 1.156 . . . . 0.0 113.121 -168.109 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -75.78 1.28 8.27 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 124.03 3.153 . . . . 0.0 113.786 175.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -89.96 -1.74 75.93 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 125.505 1.526 . . . . 0.0 113.707 178.71 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 37.8 tp60 -68.48 134.38 50.02 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.053 0.941 . . . . 0.0 109.861 173.458 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 53.3 t0 -68.72 108.2 3.3 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 123.856 0.862 . . . . 0.0 111.595 177.858 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 21.0 m -65.78 -11.99 50.43 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 115.116 1.525 . . . . 0.0 115.116 -172.23 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 41.0 mtm180 -58.17 -41.87 84.79 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.491 1.116 . . . . 0.0 112.82 174.414 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -67.61 111.28 4.09 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.397 1.079 . . . . 0.0 110.038 171.332 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 44.3 ttp85 -120.5 139.8 52.36 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.351 1.86 . . . . 0.0 111.436 -173.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 8.6 t -109.82 131.23 61.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 125.021 1.328 . . . . 0.0 108.845 168.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 73.7 m -130.12 135.73 48.53 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.326 1.05 . . . . 0.0 109.731 172.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -92.7 126.97 38.02 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.047 1.339 . . . . 0.0 109.464 -176.025 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 86.6 mt -90.66 151.48 43.94 Favored Pre-proline 0 N--CA 1.472 0.662 0 C-N-CA 123.837 0.855 . . . . 0.0 112.968 -174.319 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -64.62 -2.41 5.18 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 123.783 2.989 . . . . 0.0 114.058 176.386 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -64.92 -25.97 68.11 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 119.572 1.078 . . . . 0.0 112.648 169.496 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 95.57 -34.09 5.08 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 126.209 1.861 . . . . 0.0 114.016 176.546 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 46.2 mtm105 -138.32 73.64 1.45 Allowed 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.117 1.367 . . . . 0.0 109.615 169.359 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -165.11 140.38 5.26 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 127.77 2.428 . . . . 0.0 107.132 177.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -143.7 134.85 25.68 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 -167.001 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.4 t-160 -96.16 113.41 25.01 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 127.452 2.301 . . . . 0.0 110.341 -177.094 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 24.9 mmt -107.7 105.64 15.59 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.875 1.67 . . . . 0.0 109.782 179.597 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 8.2 t -116.48 125.27 51.72 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -169.593 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 21.4 t -87.93 88.8 2.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 N-CA-C 106.036 -1.838 . . . . 0.0 106.036 167.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 87.7 t -65.79 119.37 10.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 178.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 62.6 72.29 0.5 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.804 1.641 . . . . 0.0 111.308 -177.287 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -80.39 139.2 36.63 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.31 1.044 . . . . 0.0 112.088 178.381 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -112.07 170.05 8.42 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.976 1.71 . . . . 0.0 109.847 175.122 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 27.7 mtp180 -56.23 -34.98 66.84 Favored 'General case' 0 N--CA 1.48 1.066 0 O-C-N 120.86 -1.15 . . . . 0.0 113.436 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 23.7 p30 -63.96 -18.72 64.55 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 115.161 1.541 . . . . 0.0 115.161 175.122 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -80.56 -7.35 59.21 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.071 0.948 . . . . 0.0 112.656 174.032 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.4 m -61.85 134.89 57.27 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.086 -1.634 . . . . 0.0 111.11 171.485 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 159.96 -169.2 35.85 Favored Glycine 0 N--CA 1.471 0.979 0 C-N-CA 124.334 0.969 . . . . 0.0 113.315 -177.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 7.7 m -91.84 142.71 27.28 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.349 1.06 . . . . 0.0 110.319 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -138.98 155.82 47.71 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.539 1.536 . . . . 0.0 111.967 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -159.55 154.56 24.9 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.188 1.395 . . . . 0.0 112.877 178.141 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 3.3 t -107.91 167.01 10.28 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.091 1.756 . . . . 0.0 111.342 -173.424 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -159.76 168.79 35.63 Favored Glycine 0 CA--C 1.527 0.818 0 O-C-N 121.196 -0.94 . . . . 0.0 114.208 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -143.9 155.59 44.14 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.954 1.302 . . . . 0.0 112.152 174.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.8 tt -155.68 138.05 6.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 125.652 1.581 . . . . 0.0 110.888 178.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 4.8 m -64.51 161.52 17.14 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.458 1.103 . . . . 0.0 113.067 179.041 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 43.6 mt -74.24 -16.79 60.94 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 -178.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -69.37 150.11 97.16 Favored Pre-proline 0 CA--C 1.552 1.027 0 C-N-CA 124.619 1.167 . . . . 0.0 112.642 178.634 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.59 -20.93 35.01 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 123.106 2.537 . . . . 0.0 113.1 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -82.93 0.84 42.53 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 124.784 1.234 . . . . 0.0 113.964 178.071 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.68 168.52 13.0 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.167 1.387 . . . . 0.0 113.83 -176.543 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -147.28 156.29 42.8 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.859 1.663 . . . . 0.0 110.038 175.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 52.8 mt -81.57 127.03 39.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 123.082 0.553 . . . . 0.0 111.303 -171.342 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -95.09 114.49 26.3 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.251 1.82 . . . . 0.0 108.17 168.036 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -94.52 150.43 20.26 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.46 1.104 . . . . 0.0 111.866 -176.508 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 60.2 p -85.59 176.64 8.08 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.777 0.831 . . . . 0.0 112.498 169.05 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -69.7 159.88 32.68 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 121.676 -0.64 . . . . 0.0 109.988 165.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -93.44 159.85 15.07 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 -176.2 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -140.65 163.87 31.72 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.412 1.885 . . . . 0.0 111.827 178.161 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -105.28 138.88 40.78 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.105 1.362 . . . . 0.0 112.199 177.468 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 42.7 tp -108.52 131.37 54.9 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 126.343 1.857 . . . . 0.0 107.652 167.393 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 30.4 ttm180 -133.78 113.23 12.07 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 124.456 1.102 . . . . 0.0 109.532 -177.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 30.8 t -107.08 112.81 41.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 C-N-CA 124.394 1.078 . . . . 0.0 109.301 -175.724 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 72.7 p -93.44 160.43 14.81 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 126.622 1.969 . . . . 0.0 111.177 -176.062 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -62.5 142.91 57.71 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.857 0.863 . . . . 0.0 113.226 -172.217 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -65.22 116.71 6.86 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.473 1.109 . . . . 0.0 108.747 176.271 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 36.8 ptt180 -66.73 156.51 35.18 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.332 0.864 . . . . 0.0 113.332 -173.559 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -79.21 145.41 33.63 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 123.852 0.861 . . . . 0.0 111.001 169.317 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 60.5 mt-10 . . . . . 0 C--O 1.254 1.336 0 C-N-CA 125.921 1.688 . . . . 0.0 112.395 -177.033 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 78.6 mmm . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 116.043 -1.932 . . . . 0.0 113.084 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_exo -53.67 155.17 14.27 Favored 'Trans proline' 0 C--N 1.358 1.027 0 C-N-CA 122.903 2.402 . . . . 0.0 112.675 172.718 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -67.35 109.2 1.73 Allowed 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 123.478 2.785 . . . . 0.0 110.357 -175.203 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 58.7 m -130.76 148.16 52.51 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.098 1.359 . . . . 0.0 110.504 -169.43 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 93.9 t80 -140.37 116.95 10.83 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 126.972 2.109 . . . . 0.0 108.214 174.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 38.1 m -140.83 160.95 56.64 Favored Pre-proline 0 N--CA 1.479 0.983 0 C-N-CA 124.545 1.138 . . . . 0.0 113.494 -168.044 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -68.53 156.88 88.86 Favored 'Cis proline' 0 C--N 1.355 0.897 0 CA-C-N 119.982 1.029 . . . . 0.0 111.751 -2.117 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.33 -28.07 64.72 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.802 0.841 . . . . 0.0 113.074 175.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -134.96 118.13 16.53 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 126.224 1.81 . . . . 0.0 109.187 173.157 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 51.7 tp -109.1 122.3 47.0 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.963 0.905 . . . . 0.0 109.761 171.309 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 32.2 t -106.84 122.92 61.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 124.132 0.973 . . . . 0.0 109.269 175.571 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.0 m -128.98 172.34 15.5 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 C-N-CA 125.04 1.336 . . . . 0.0 112.036 170.875 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 31.9 m -99.14 151.82 20.56 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.812 1.645 . . . . 0.0 110.693 177.195 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -47.19 122.07 4.25 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.998 1.319 . . . . 0.0 112.013 169.413 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 85.79 -1.85 87.95 Favored Glycine 0 CA--C 1.532 1.123 0 C-N-CA 125.736 1.636 . . . . 0.0 114.576 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 39.4 t0 -87.09 157.41 19.41 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.245 1.523 . . . . 0.0 111.393 175.133 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -84.08 150.62 25.45 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 121.903 0.859 . . . . 0.0 111.302 169.736 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -132.41 131.25 41.6 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.267 1.827 . . . . 0.0 110.03 -175.492 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 89.8 m -131.58 127.05 36.33 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.286 0.948 . . . . 0.0 111.82 179.167 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -100.11 159.54 15.02 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.002 1.721 . . . . 0.0 110.516 169.525 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 58.8 m -110.32 132.5 54.12 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.661 1.584 . . . . 0.0 109.88 174.455 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 39.5 t -116.73 144.1 44.86 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.991 1.716 . . . . 0.0 112.003 173.067 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 80.9 p -151.41 140.51 21.18 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.713 0.805 . . . . 0.0 112.115 171.849 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -131.09 156.15 45.71 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.49 1.916 . . . . 0.0 112.754 -174.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 26.5 t -93.96 130.15 40.17 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.072 0.949 . . . . 0.0 109.09 167.721 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -144.15 156.55 44.37 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.991 1.316 . . . . 0.0 110.828 -174.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.0 t -74.61 -173.62 1.85 Allowed 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.093 0.957 . . . . 0.0 111.765 175.522 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 3.0 t -81.9 39.66 0.57 Allowed 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 125.812 1.645 . . . . 0.0 112.404 178.526 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -144.28 148.97 35.54 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 126.848 2.059 . . . . 0.0 109.248 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 28.4 m -69.33 156.6 38.52 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 122.851 1.31 . . . . 0.0 114.368 -173.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 54.2 p90 -146.86 155.77 42.58 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.272 1.429 . . . . 0.0 111.999 -175.222 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.3 t -96.01 135.76 29.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 125.594 1.557 . . . . 0.0 107.646 169.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -119.41 129.23 54.68 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.169 1.388 . . . . 0.0 108.841 -175.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -130.94 155.72 46.31 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.282 1.433 . . . . 0.0 113.144 -168.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 18.2 t90 -123.32 139.09 54.39 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.662 1.185 . . . . 0.0 112.257 179.561 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -133.07 147.66 52.18 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.214 1.406 . . . . 0.0 113.665 -173.693 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 51.2 ttp180 -110.28 141.11 43.73 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 127.419 2.288 . . . . 0.0 108.567 169.281 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 38.2 mtp -92.94 145.87 24.05 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.252 0.933 . . . . 0.0 112.155 178.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 24.0 p -90.85 165.54 21.87 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 123.626 0.77 . . . . 0.0 112.983 176.606 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.01 -29.04 89.59 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 123.589 2.859 . . . . 0.0 113.358 169.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 36.1 m -83.39 12.46 5.45 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.195 1.398 . . . . 0.0 112.89 174.645 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 63.4 t30 63.44 23.56 13.74 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.554 1.941 . . . . 0.0 113.353 178.105 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 46.4 mm-40 -89.7 -172.73 3.67 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.483 0.713 . . . . 0.0 109.798 170.723 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.4 p -137.58 143.5 41.55 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.347 1.459 . . . . 0.0 110.902 -176.537 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -123.73 129.77 51.61 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 126.572 1.949 . . . . 0.0 109.775 -178.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 74.3 tttt -86.6 119.66 27.08 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.604 1.162 . . . . 0.0 110.962 -171.525 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 65.9 mt -95.04 -51.07 4.81 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.696 1.199 . . . . 0.0 112.381 -168.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -167.37 171.72 10.34 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.321 1.448 . . . . 0.0 111.564 -174.139 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -150.09 158.36 44.08 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.104 1.362 . . . . 0.0 113.112 -169.793 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -137.26 136.94 21.33 Favored Pre-proline 0 CA--C 1.548 0.895 0 C-N-CA 125.687 1.595 . . . . 0.0 110.203 169.375 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -58.25 143.82 26.63 Favored 'Cis proline' 0 C--N 1.352 0.75 0 CA-C-N 120.279 1.136 . . . . 0.0 112.089 -8.566 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -88.04 152.81 21.75 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.248 1.019 . . . . 0.0 112.991 -173.312 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -153.25 136.81 15.95 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.095 1.358 . . . . 0.0 111.454 171.647 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -100.04 -8.88 23.29 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.714 1.606 . . . . 0.0 113.19 176.808 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 12.0 m -75.69 -35.79 60.24 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.297 -0.877 . . . . 0.0 112.435 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -69.83 159.97 81.91 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 124.145 0.978 . . . . 0.0 112.98 173.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -61.09 152.84 68.67 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 123.263 2.642 . . . . 0.0 111.31 167.622 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 99.96 17.29 25.77 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 124.023 0.82 . . . . 0.0 113.848 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -61.04 135.55 57.81 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.143 0.977 . . . . 0.0 110.81 173.317 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -142.89 148.83 37.63 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.441 1.496 . . . . 0.0 111.602 -178.69 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 54.5 p -101.4 -7.73 22.65 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 115.673 1.731 . . . . 0.0 115.673 -172.489 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.3 ptp85 -123.98 -18.97 5.79 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 115.247 1.573 . . . . 0.0 115.247 -169.57 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -111.88 140.48 46.5 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.714 1.606 . . . . 0.0 111.138 177.359 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 21.2 ttt-85 -144.4 143.72 31.06 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.832 0.853 . . . . 0.0 113.024 174.523 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 60.1 t -111.75 127.15 69.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 125.154 1.381 . . . . 0.0 107.704 167.58 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 76.3 m -130.55 129.55 42.96 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.09 0.956 . . . . 0.0 109.954 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -80.27 139.74 36.52 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.49 0.716 . . . . 0.0 110.978 176.04 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 30.6 mt -84.56 160.38 56.52 Favored Pre-proline 0 CA--C 1.545 0.766 0 C-N-CA 124.906 1.282 . . . . 0.0 111.669 176.097 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -62.32 -5.07 6.11 Favored 'Trans proline' 0 CA--C 1.543 0.931 0 C-N-CA 123.542 2.828 . . . . 0.0 114.704 174.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -62.64 -26.13 68.47 Favored 'General case' 0 CA--C 1.551 1.019 0 CA-C-N 119.569 1.077 . . . . 0.0 112.746 169.085 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 94.08 -17.06 59.56 Favored Glycine 0 N--CA 1.475 1.274 0 C-N-CA 125.59 1.567 . . . . 0.0 114.692 173.777 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 11.0 ptp180 -154.5 73.61 0.91 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.477 1.511 . . . . 0.0 109.839 169.566 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -166.44 140.6 4.19 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 128.652 2.781 . . . . 0.0 107.003 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -141.16 143.04 34.02 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 -166.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 17.1 m170 -105.55 132.84 51.21 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.524 1.529 . . . . 0.0 111.711 169.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -112.73 101.82 9.9 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 127.154 2.182 . . . . 0.0 109.298 -178.023 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 60.6 m -109.23 124.12 50.35 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 -169.087 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 37.2 t -93.53 125.99 46.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 126.278 1.831 . . . . 0.0 106.401 167.094 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 57.9 t -96.57 126.57 49.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 124.069 0.948 . . . . 0.0 109.408 171.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 67.1 ttt180 58.32 66.15 1.15 Allowed 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.778 1.631 . . . . 0.0 111.826 174.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -72.37 135.54 45.89 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 121.351 -0.843 . . . . 0.0 111.798 -178.514 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -111.49 164.86 12.52 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.93 1.692 . . . . 0.0 110.202 174.33 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 31.0 mtp180 -56.88 -32.99 66.41 Favored 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -171.664 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -64.97 -16.11 62.99 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 175.598 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 65.5 m-20 -79.73 -13.52 59.39 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 119.329 0.968 . . . . 0.0 112.8 173.814 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 20.4 m -63.45 129.23 39.36 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 120.868 -1.145 . . . . 0.0 111.566 177.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 158.8 -169.04 35.07 Favored Glycine 0 N--CA 1.47 0.908 0 C-N-CA 124.183 0.896 . . . . 0.0 113.286 -172.342 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.4 m -92.79 143.27 26.45 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.727 1.211 . . . . 0.0 111.267 -173.156 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -141.73 157.19 45.35 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.542 1.937 . . . . 0.0 111.267 -177.494 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -160.53 159.93 31.29 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.855 1.262 . . . . 0.0 113.617 177.668 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 39.1 t -103.07 149.47 24.56 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.911 1.685 . . . . 0.0 111.57 177.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -144.57 152.64 24.55 Favored Glycine 0 N--CA 1.471 1.015 0 C-N-CA 124.688 1.137 . . . . 0.0 113.182 175.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -132.39 154.63 49.62 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.629 1.171 . . . . 0.0 112.775 -176.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.3 tt -153.31 135.41 6.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 125.104 1.361 . . . . 0.0 110.995 177.211 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 12.6 m -67.98 158.28 33.17 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 121.099 -1.001 . . . . 0.0 112.498 177.632 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.7 -9.18 56.6 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 115.689 1.737 . . . . 0.0 115.689 -177.247 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -78.38 144.16 65.67 Favored Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 124.241 1.016 . . . . 0.0 112.281 -178.374 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -55.56 -29.04 68.01 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 123.748 2.965 . . . . 0.0 114.858 177.22 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -76.99 -5.99 50.85 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 115.056 1.502 . . . . 0.0 115.056 179.394 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.41 164.2 23.54 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.519 1.127 . . . . 0.0 113.365 -176.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -144.59 161.34 39.37 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.674 1.589 . . . . 0.0 110.295 173.75 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 56.8 mt -78.98 118.17 25.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 123.65 0.78 . . . . 0.0 111.158 -172.002 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 59.0 tttp -89.62 137.53 32.25 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.719 1.608 . . . . 0.0 109.214 168.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -115.29 152.75 32.18 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.448 1.099 . . . . 0.0 112.147 -173.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 78.3 p -97.59 172.55 7.65 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.077 1.351 . . . . 0.0 114.118 177.34 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 14.4 tp -69.99 119.8 14.75 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.144 1.378 . . . . 0.0 108.607 169.374 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 34.8 ptt-85 -71.35 163.93 26.72 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.101 1.36 . . . . 0.0 113.879 -175.041 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -142.64 169.65 17.18 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.807 2.043 . . . . 0.0 111.234 179.492 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -117.65 146.16 43.87 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 114.055 1.131 . . . . 0.0 114.055 174.236 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 66.8 tp -100.21 137.11 39.1 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 127.112 2.165 . . . . 0.0 108.875 169.227 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 29.3 ttm180 -132.02 117.56 18.55 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.293 1.437 . . . . 0.0 109.964 178.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 40.6 t -106.46 113.21 42.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 125.226 1.41 . . . . 0.0 108.904 178.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 73.8 p -95.01 160.69 14.46 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.824 1.65 . . . . 0.0 111.47 -178.349 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -57.74 144.9 36.46 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.732 1.213 . . . . 0.0 113.686 -173.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 69.7 ttp85 -66.63 118.2 9.87 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 124.278 1.031 . . . . 0.0 109.607 179.38 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.71 152.65 45.25 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -175.193 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -64.72 154.29 37.17 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.364 1.066 . . . . 0.0 113.447 179.018 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 . . . . . 0 N--CA 1.49 1.533 0 C-N-CA 130.605 3.562 . . . . 0.0 113.022 176.718 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 33' ' ' MET . . . . . 0.613 ' N ' ' HG ' ' A' ' 55' ' ' SER . 4.7 mpp? . . . . . 0 N--CA 1.489 1.498 0 CA-C-O 116.768 -1.587 . . . . 0.0 114.418 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -73.06 159.73 47.12 Favored 'Trans proline' 0 C--N 1.357 0.988 0 C-N-CA 122.436 2.091 . . . . 0.0 112.218 -173.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -64.75 114.59 2.82 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 124.008 3.138 . . . . 0.0 111.535 -178.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.1 t -167.68 163.3 14.37 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.826 1.25 . . . . 0.0 113.221 -174.419 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -152.78 119.88 5.84 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.66 1.984 . . . . 0.0 110.658 175.311 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 94.9 p -140.93 164.19 37.72 Favored Pre-proline 0 CA--C 1.553 1.075 0 C-N-CA 125.446 1.498 . . . . 0.0 112.755 -172.704 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -70.24 170.65 59.52 Favored 'Cis proline' 0 C--N 1.355 0.873 0 CA-C-N 120.629 1.26 . . . . 0.0 112.396 -2.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.04 -32.94 74.42 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 171.558 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 49.1 tp -144.92 124.69 13.36 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.559 1.544 . . . . 0.0 109.586 171.672 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 62.1 tp -102.18 132.75 47.9 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.975 1.31 . . . . 0.0 108.888 169.054 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 24.7 t -112.65 127.29 69.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 124.072 0.949 . . . . 0.0 108.466 171.037 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 33.2 m -131.4 166.26 29.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 124.624 1.17 . . . . 0.0 111.708 175.094 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 25.4 m -90.5 148.91 22.43 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.258 1.023 . . . . 0.0 110.229 173.393 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -59.13 116.05 3.59 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.544 1.538 . . . . 0.0 111.357 176.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.17 5.47 65.7 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 126.385 1.945 . . . . 0.0 114.765 -174.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -92.05 154.78 18.54 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.355 1.578 . . . . 0.0 112.132 173.223 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 49.5 m-80 -71.08 120.44 16.65 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.455 1.102 . . . . 0.0 110.753 173.22 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -97.9 128.09 44.27 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 117.867 -1.063 . . . . 0.0 110.076 174.457 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 28.4 m -132.74 132.08 41.89 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.169 0.988 . . . . 0.0 111.184 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -119.97 159.55 24.5 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 128.03 2.532 . . . . 0.0 109.982 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 49.7 m -105.44 124.44 49.55 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.332 1.053 . . . . 0.0 109.468 178.216 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 54.1 t -118.45 150.37 39.69 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.849 1.259 . . . . 0.0 110.908 169.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.613 ' HG ' ' N ' ' A' ' 33' ' ' MET . 27.4 t -152.9 146.49 25.04 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 120.734 -1.229 . . . . 0.0 111.763 169.534 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 48.3 m-85 -146.24 156.11 43.15 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 127.981 2.513 . . . . 0.0 110.887 172.801 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.7 t -141.34 142.87 33.78 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.083 1.353 . . . . 0.0 109.369 169.44 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -139.36 155.29 47.76 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.606 1.162 . . . . 0.0 112.184 -173.648 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 24.3 p -83.83 -16.41 44.67 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 126.097 1.759 . . . . 0.0 114.388 -173.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 7.3 t -81.72 -176.93 6.33 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.89 0.876 . . . . 0.0 112.613 176.349 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -73.07 -23.22 60.53 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.861 1.264 . . . . 0.0 113.498 -172.537 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.7 t -169.14 166.52 10.8 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.11 1.764 . . . . 0.0 110.798 -179.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -150.57 151.2 32.24 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.667 1.187 . . . . 0.0 112.171 177.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 24.8 t -96.05 133.58 36.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 125.48 1.512 . . . . 0.0 107.853 172.485 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 14.6 tp -99.42 140.76 33.13 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.445 1.098 . . . . 0.0 110.088 172.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -132.32 151.98 51.61 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.466 1.906 . . . . 0.0 110.507 -179.433 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 14.1 t90 -125.9 146.15 49.96 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.091 0.956 . . . . 0.0 112.405 178.098 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -141.07 143.52 34.4 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 -169.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -103.96 142.05 35.1 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.05 1.34 . . . . 0.0 107.951 167.126 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 22.6 mtp -88.49 145.91 25.48 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 118.897 0.771 . . . . 0.0 112.659 179.441 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 64.5 m -96.1 152.26 38.76 Favored Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 125.134 1.374 . . . . 0.0 110.923 171.158 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -67.52 -12.62 36.32 Favored 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 123.632 2.888 . . . . 0.0 113.621 -179.4 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 29.1 p -76.96 4.04 10.84 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 126.255 1.822 . . . . 0.0 113.633 169.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 59.8 t30 67.04 41.51 2.63 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.88 2.072 . . . . 0.0 111.347 -174.387 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 21.5 mm-40 -121.46 -172.69 2.47 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.59 1.956 . . . . 0.0 109.594 176.037 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 12.5 p -146.3 152.56 39.34 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.102 1.361 . . . . 0.0 111.404 -172.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -127.04 132.37 50.72 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.988 1.315 . . . . 0.0 110.919 173.781 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -78.75 124.98 28.76 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.484 1.114 . . . . 0.0 111.21 -175.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 74.0 mt -100.66 -44.61 5.77 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.341 1.456 . . . . 0.0 112.829 -169.684 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -166.21 170.92 12.79 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.165 1.786 . . . . 0.0 110.638 -171.463 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -155.93 163.43 39.76 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.661 1.184 . . . . 0.0 112.796 -177.017 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -141.8 121.31 8.1 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 125.269 1.428 . . . . 0.0 110.035 169.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -54.83 146.97 18.47 Favored 'Cis proline' 0 C--N 1.352 0.736 0 CA-C-N 120.378 1.171 . . . . 0.0 112.984 -7.287 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -80.41 144.07 32.95 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 121.976 0.893 . . . . 0.0 113.293 -170.327 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -85.11 33.46 0.54 Allowed 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.818 1.647 . . . . 0.0 113.062 -174.325 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 6.9 ppt_? -63.56 -8.13 8.92 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 115.799 1.778 . . . . 0.0 115.799 -169.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 33.1 p -73.21 -19.42 61.09 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.648 1.179 . . . . 0.0 113.116 171.112 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -106.17 164.58 14.65 Favored Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 125.48 1.512 . . . . 0.0 111.118 174.726 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_exo -56.66 160.66 11.31 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 124.061 3.174 . . . . 0.0 113.942 173.41 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 91.94 31.11 9.49 Favored Glycine 0 CA--C 1.533 1.201 0 C-N-CA 124.17 0.891 . . . . 0.0 113.135 -174.426 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -72.37 -20.87 61.38 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.846 1.258 . . . . 0.0 113.445 -175.051 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -142.94 55.4 1.39 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.151 1.38 . . . . 0.0 111.286 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 50.8 m -84.21 9.45 12.8 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.976 1.31 . . . . 0.0 113.866 178.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 43.7 mtm180 80.63 -34.13 0.12 Allowed 'General case' 0 C--N 1.346 0.432 0 C-N-CA 131.493 3.917 . . . . 0.0 113.803 178.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -65.03 129.46 39.79 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.356 1.462 . . . . 0.0 110.813 169.291 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 59.0 ttp85 -144.45 154.0 42.48 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.733 1.613 . . . . 0.0 112.102 -170.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 17.7 t -117.54 138.02 49.57 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 125.994 1.718 . . . . 0.0 110.166 173.16 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 3.1 m -114.54 128.38 56.3 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.237 1.415 . . . . 0.0 110.153 171.262 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 28.0 tp60 -84.84 122.38 29.07 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.531 1.132 . . . . 0.0 108.222 168.642 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 24.6 mt -84.56 154.96 62.52 Favored Pre-proline 0 N--CA 1.472 0.668 0 CA-C-O 118.766 -0.635 . . . . 0.0 110.751 176.001 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -65.95 -4.93 10.99 Favored 'Trans proline' 0 CA--C 1.54 0.777 0 C-N-CA 123.571 2.847 . . . . 0.0 113.926 176.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -64.95 -26.12 68.17 Favored 'General case' 0 CA--C 1.55 0.96 0 CA-C-N 119.434 1.016 . . . . 0.0 112.182 169.168 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 85.44 -34.09 3.34 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 126.592 2.044 . . . . 0.0 113.867 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 17.2 mtp180 -125.88 73.51 1.35 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.771 1.228 . . . . 0.0 109.197 174.284 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 174.12 142.2 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 128.757 2.823 . . . . 0.0 109.057 -174.701 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 84.6 m-85 -149.79 151.46 33.6 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.553 1.141 . . . . 0.0 112.66 -167.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 5.8 m-70 -116.34 114.48 24.37 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.512 0.725 . . . . 0.0 111.344 169.385 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 24.6 mmt -84.23 144.04 29.19 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.293 1.037 . . . . 0.0 109.371 172.499 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 72.3 p -151.36 151.77 32.21 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 115.565 1.691 . . . . 0.0 115.565 -179.146 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 16.0 t -109.69 116.2 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 125.526 1.531 . . . . 0.0 107.466 169.318 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 96.9 t -70.86 112.52 5.78 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 170.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 80.5 mtt85 57.49 77.09 0.29 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.392 1.477 . . . . 0.0 111.317 178.517 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.29 132.88 45.56 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.595 1.158 . . . . 0.0 111.325 -179.437 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 8.6 mpt_? -105.84 163.26 12.86 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.767 1.627 . . . . 0.0 109.989 176.143 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 73.9 mtm180 -57.52 -20.23 30.12 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 175.691 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -54.59 -29.95 53.06 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.977 1.711 . . . . 0.0 113.668 167.568 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 36.4 m-20 -93.21 -12.74 29.52 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.059 1.344 . . . . 0.0 114.551 -168.284 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 49.5 m -59.42 139.46 57.06 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 119.602 1.092 . . . . 0.0 112.768 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 149.35 -163.83 29.27 Favored Glycine 0 N--CA 1.472 1.053 0 C-N-CA 124.131 0.872 . . . . 0.0 113.435 -178.132 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.7 m -92.64 147.53 22.8 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.006 1.322 . . . . 0.0 110.702 -178.063 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -142.29 158.75 43.37 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.641 1.976 . . . . 0.0 111.253 -176.126 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.5 pp -154.36 158.84 40.69 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.914 1.286 . . . . 0.0 112.112 172.613 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 9.3 t -108.45 161.48 15.0 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.071 1.748 . . . . 0.0 110.291 177.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -157.46 155.3 26.29 Favored Glycine 0 N--CA 1.47 0.943 0 O-C-N 120.945 -1.097 . . . . 0.0 114.36 176.26 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -130.58 154.2 48.09 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.433 1.093 . . . . 0.0 112.818 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.6 tt -148.21 135.3 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 125.428 1.491 . . . . 0.0 110.528 176.883 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 23.3 m -67.04 161.1 25.16 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -179.285 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.26 -17.5 64.55 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 -175.657 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -78.51 148.9 74.33 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 124.744 1.218 . . . . 0.0 112.473 -177.36 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -67.9 -23.08 41.5 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.108 2.539 . . . . 0.0 113.069 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.8 pttp -80.31 -1.76 42.36 Favored 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 114.654 1.353 . . . . 0.0 114.654 176.48 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -67.83 164.32 19.89 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.731 1.212 . . . . 0.0 113.135 -179.442 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -137.05 155.77 49.24 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.771 1.628 . . . . 0.0 109.394 176.04 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 50.8 mt -79.24 125.25 38.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 123.343 0.657 . . . . 0.0 110.673 -176.406 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -95.69 120.91 36.79 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.899 1.68 . . . . 0.0 109.414 169.767 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -91.57 151.81 20.57 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.661 1.185 . . . . 0.0 112.223 -177.743 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 56.0 p -85.99 178.96 7.09 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.347 1.059 . . . . 0.0 112.426 169.495 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -71.67 159.33 34.59 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.523 -0.735 . . . . 0.0 110.688 166.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 70.3 mtt180 -75.41 143.43 42.73 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 123.991 0.916 . . . . 0.0 112.172 -178.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -124.17 166.46 15.79 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.749 2.02 . . . . 0.0 110.105 169.348 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -126.66 152.76 46.29 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.579 1.151 . . . . 0.0 111.707 177.288 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 64.7 tp -125.35 132.9 52.75 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 126.181 1.792 . . . . 0.0 109.4 172.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 53.9 ttp180 -123.0 117.19 24.91 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.948 1.299 . . . . 0.0 109.875 169.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 40.8 t -96.29 120.37 45.57 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 169.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 82.8 p -99.07 149.29 23.17 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.752 1.621 . . . . 0.0 109.932 177.124 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 38.8 mp0 -53.31 149.01 7.83 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.8 1.24 . . . . 0.0 113.402 -174.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -62.6 123.48 18.47 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 124.543 1.137 . . . . 0.0 109.667 -178.838 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 66.2 mtt-85 -76.12 153.31 36.37 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.874 0.87 . . . . 0.0 112.835 -167.603 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -71.49 154.38 41.53 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.554 1.142 . . . . 0.0 112.424 175.156 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 . . . . . 0 C--O 1.252 1.184 0 C-N-CA 125.186 1.394 . . . . 0.0 112.998 176.907 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 5.3 mpp? . . . . . 0 N--CA 1.489 1.477 0 CA-C-O 118.65 -0.691 . . . . 0.0 110.445 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -77.21 171.1 18.39 Favored 'Trans proline' 0 CA--C 1.547 1.128 0 C-N-CA 123.842 3.028 . . . . 0.0 111.875 175.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_exo -54.04 144.03 59.27 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 124.249 3.299 . . . . 0.0 112.22 168.729 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 17.0 p -136.64 137.79 40.44 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.59 1.156 . . . . 0.0 111.185 -178.058 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -120.85 140.09 52.25 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.97 1.308 . . . . 0.0 110.527 -174.442 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 16.9 m -140.91 156.76 68.47 Favored Pre-proline 0 CA--C 1.547 0.855 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 178.613 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -71.1 155.13 96.94 Favored 'Cis proline' 0 C--N 1.35 0.655 0 N-CA-C 110.367 -0.666 . . . . 0.0 110.367 -12.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.68 -30.19 67.18 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 173.31 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 46.0 tp -138.53 118.86 13.67 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.645 1.578 . . . . 0.0 109.095 170.596 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.4 tp -101.19 126.89 47.95 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.241 1.416 . . . . 0.0 109.229 172.504 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.6 t -109.79 124.54 66.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 171.71 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.8 m -128.09 174.28 11.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 C-N-CA 124.814 1.245 . . . . 0.0 111.284 172.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 33.8 m -104.34 151.85 22.96 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.657 1.583 . . . . 0.0 110.281 174.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -45.25 122.87 3.66 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.082 1.753 . . . . 0.0 112.509 171.728 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.27 0.42 89.48 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 125.902 1.715 . . . . 0.0 115.126 -179.011 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -88.08 155.77 19.63 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 119.768 1.784 . . . . 0.0 112.629 177.394 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -76.14 121.83 23.42 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.839 1.256 . . . . 0.0 110.771 173.13 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -101.4 131.45 47.48 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.112 0.965 . . . . 0.0 110.688 175.073 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 21.3 m -132.76 124.96 29.07 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.822 0.849 . . . . 0.0 111.531 -178.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -104.96 159.46 15.8 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 126.041 1.736 . . . . 0.0 111.102 170.364 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 32.2 m -120.52 138.59 53.76 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.615 1.566 . . . . 0.0 110.052 177.018 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 74.4 m -128.6 137.5 51.73 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.023 1.329 . . . . 0.0 110.938 169.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 47.6 p -124.89 140.9 52.51 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.39 0.676 . . . . 0.0 109.673 170.268 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -127.07 140.8 52.03 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 113.988 1.107 . . . . 0.0 113.988 -169.053 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 12.6 p -99.12 138.49 36.15 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.671 1.588 . . . . 0.0 107.652 165.636 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -159.04 138.44 11.51 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.139 -0.976 . . . . 0.0 111.847 -169.4 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.2 p -79.75 -18.43 51.12 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 125.732 1.613 . . . . 0.0 113.979 -176.071 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 8.0 t -88.49 177.69 6.73 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.269 1.028 . . . . 0.0 111.839 172.656 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -74.1 -34.53 63.99 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.849 1.26 . . . . 0.0 111.275 176.327 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.1 t -160.01 174.39 14.43 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.802 1.241 . . . . 0.0 111.739 -179.694 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 42.7 p90 -160.82 164.14 31.6 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.493 1.517 . . . . 0.0 111.743 -169.136 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 40.7 t -95.85 125.5 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 N-CA-C 106.487 -1.671 . . . . 0.0 106.487 169.541 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 37.6 tp -99.38 139.33 35.19 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 123.054 0.541 . . . . 0.0 109.647 174.495 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -128.16 137.12 51.94 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.544 1.538 . . . . 0.0 109.997 -176.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 68.9 t-105 -98.19 134.93 40.56 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.68 1.192 . . . . 0.0 110.699 173.267 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 90.5 m-85 -124.2 143.42 50.52 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.913 1.285 . . . . 0.0 112.805 -178.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 56.8 ttp85 -95.83 142.96 27.48 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 126.542 1.937 . . . . 0.0 107.874 167.157 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 33.1 mtp -91.61 144.89 25.07 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 118.826 0.739 . . . . 0.0 112.206 172.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 58.8 m -108.96 149.49 39.67 Favored Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 125.559 1.543 . . . . 0.0 110.85 171.264 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -69.01 -14.88 39.32 Favored 'Trans proline' 0 C--N 1.353 0.784 0 C-N-CA 123.879 3.053 . . . . 0.0 114.482 -171.023 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 6.1 t -76.91 7.92 4.31 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 119.098 0.863 . . . . 0.0 113.153 170.168 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 34.3 m-80 75.6 36.79 0.45 Allowed 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 127.896 2.479 . . . . 0.0 112.039 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -115.84 172.61 7.03 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.176 1.39 . . . . 0.0 111.007 179.743 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.8 p -132.62 152.49 51.63 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 125.842 1.657 . . . . 0.0 111.505 -178.231 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -138.51 125.89 21.77 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.539 1.536 . . . . 0.0 110.927 -177.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -77.64 125.33 29.17 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.138 0.975 . . . . 0.0 111.218 -176.519 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 25.4 mt -102.09 -43.35 5.78 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.894 0.878 . . . . 0.0 112.944 -179.016 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -157.46 168.13 28.22 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.377 1.471 . . . . 0.0 111.455 -172.402 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.66 167.86 27.41 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.44 1.096 . . . . 0.0 112.862 -178.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -142.22 126.16 9.84 Favored Pre-proline 0 CA--C 1.543 0.674 0 C-N-CA 124.661 1.185 . . . . 0.0 110.33 169.112 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -56.76 153.83 28.38 Favored 'Cis proline' 0 C--N 1.351 0.677 0 CA-C-N 119.355 0.805 . . . . 0.0 112.725 -10.649 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -75.88 94.75 3.39 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 121.677 0.751 . . . . 0.0 111.659 -177.667 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -79.15 0.69 27.21 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.032 1.333 . . . . 0.0 113.645 173.099 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 64.6 mtm180 -61.24 -33.07 72.9 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.362 1.465 . . . . 0.0 112.164 176.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.7 t 70.29 -61.08 0.47 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 127.776 2.43 . . . . 0.0 115.381 168.42 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -101.69 149.05 36.1 Favored Pre-proline 0 CA--C 1.545 0.75 0 C-N-CA 124.446 1.099 . . . . 0.0 112.425 -169.619 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -80.32 164.79 21.49 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 124.06 3.173 . . . . 0.0 111.673 175.52 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 103.66 -5.76 47.97 Favored Glycine 0 N--CA 1.473 1.157 0 C-N-CA 125.291 1.425 . . . . 0.0 112.933 179.018 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.2 178.97 7.85 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.78 1.632 . . . . 0.0 111.991 171.818 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 19.2 m-20 -70.39 77.24 0.55 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.125 1.37 . . . . 0.0 112.363 178.175 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 82.0 p -68.82 -6.59 27.78 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.792 1.637 . . . . 0.0 113.933 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 5.2 ptm180 -68.6 -16.94 64.01 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.055 1.342 . . . . 0.0 113.71 171.359 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -97.8 125.53 42.69 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.898 1.279 . . . . 0.0 109.33 172.816 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -142.94 152.53 42.11 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.472 1.109 . . . . 0.0 111.945 -169.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 49.0 t -126.6 139.85 50.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.116 0 C-N-CA 124.856 1.262 . . . . 0.0 111.021 176.441 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 97.4 m -123.38 128.89 50.51 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.538 1.535 . . . . 0.0 109.509 170.046 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 37.2 tt0 -85.9 137.74 32.53 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.887 0.875 . . . . 0.0 110.149 170.396 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 34.3 mt -91.1 157.31 43.14 Favored Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 124.357 1.063 . . . . 0.0 111.894 -179.051 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -66.75 -3.85 10.08 Favored 'Trans proline' 0 CA--C 1.542 0.91 0 C-N-CA 123.664 2.91 . . . . 0.0 114.028 174.748 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -66.59 -13.66 61.37 Favored 'General case' 0 CA--C 1.555 1.147 0 CA-C-N 119.378 0.99 . . . . 0.0 112.951 170.684 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 92.32 -24.57 21.85 Favored Glycine 0 N--CA 1.476 1.307 0 C-N-CA 125.916 1.722 . . . . 0.0 115.716 168.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 11.5 ptp180 -154.5 73.64 0.92 Allowed 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.534 1.534 . . . . 0.0 109.695 172.028 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -168.89 137.0 2.01 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 128.074 2.55 . . . . 0.0 107.273 -171.458 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 55.1 m-85 -148.78 146.58 28.09 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -167.606 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 4.8 m-70 -106.03 132.5 52.04 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.283 1.433 . . . . 0.0 111.116 168.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 2.6 mpp? -112.1 120.31 41.4 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 126.361 1.864 . . . . 0.0 109.365 177.228 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 36.0 m -116.22 130.89 57.01 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.322 1.049 . . . . 0.0 112.211 -169.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 58.1 t -105.66 110.79 32.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 125.775 1.63 . . . . 0.0 107.13 168.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 96.8 t -76.29 123.44 32.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.495 1.118 . . . . 0.0 109.55 178.547 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 53.63 73.43 0.38 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.053 1.741 . . . . 0.0 111.574 177.047 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.87 132.26 44.15 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.195 0.998 . . . . 0.0 111.269 -179.136 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -106.94 161.65 14.53 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 126.198 1.799 . . . . 0.0 110.104 177.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -50.68 -35.79 32.69 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 119.292 0.951 . . . . 0.0 113.377 -178.011 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -62.88 -21.1 65.74 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 125.564 1.546 . . . . 0.0 115.003 176.585 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -76.4 -11.87 59.96 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 119.69 1.132 . . . . 0.0 113.116 177.707 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.9 m -62.93 131.08 47.5 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 120.617 -1.302 . . . . 0.0 112.349 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 156.99 -168.77 34.04 Favored Glycine 0 N--CA 1.472 1.055 0 C-N-CA 124.381 0.991 . . . . 0.0 113.703 -173.505 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.2 m -95.8 142.48 28.03 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.623 1.169 . . . . 0.0 111.219 -175.678 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -146.1 160.91 41.27 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.149 1.78 . . . . 0.0 111.071 -177.414 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -161.77 169.07 22.08 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 120.871 -1.143 . . . . 0.0 113.99 -175.474 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 6.4 m -107.06 148.26 28.96 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.178 1.391 . . . . 0.0 112.356 175.414 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -145.66 135.77 6.1 Favored Glycine 0 N--CA 1.469 0.859 0 C-N-CA 125.02 1.295 . . . . 0.0 111.523 169.2 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -113.96 157.28 22.65 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.008 0.923 . . . . 0.0 112.82 -176.013 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 19.7 tt -143.41 131.49 18.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 125.141 1.377 . . . . 0.0 110.226 172.377 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 15.3 m -68.27 161.61 26.88 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.179 1.392 . . . . 0.0 114.152 -171.834 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.9 -10.92 32.36 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 116.119 1.896 . . . . 0.0 116.119 -176.576 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -81.47 149.83 65.76 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.766 1.227 . . . . 0.0 112.427 -178.496 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -68.09 -21.5 42.63 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 123.038 2.492 . . . . 0.0 112.699 175.59 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 1.9 tppp? -81.52 -4.07 54.93 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 125.217 1.407 . . . . 0.0 113.66 177.198 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.5 164.69 13.5 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.813 1.245 . . . . 0.0 113.986 -175.47 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 38.0 tt0 -152.44 141.25 21.02 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.228 1.811 . . . . 0.0 108.437 -178.067 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 60.7 mt -59.62 140.5 17.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 124.189 0.996 . . . . 0.0 112.227 -172.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 32.5 mmtm -125.74 124.33 40.8 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.743 1.617 . . . . 0.0 110.306 169.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -147.74 141.92 26.12 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.119 1.767 . . . . 0.0 110.93 -174.417 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 8.4 t -173.35 156.65 3.14 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 126.259 1.824 . . . . 0.0 109.982 -179.332 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.1 mp 68.94 173.88 0.29 Allowed 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 127.293 2.237 . . . . 0.0 111.209 -169.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -159.63 168.22 26.57 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.611 1.564 . . . . 0.0 112.49 173.6 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -128.93 161.62 29.46 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 126.946 2.098 . . . . 0.0 110.892 173.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -116.53 139.28 50.66 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.802 1.241 . . . . 0.0 111.081 -178.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 54.4 tp -108.82 132.8 53.65 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 125.684 1.593 . . . . 0.0 109.929 171.3 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 66.2 ttt180 -122.49 119.38 30.75 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.901 1.68 . . . . 0.0 109.153 169.707 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 38.6 t -104.64 115.27 46.22 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 124.211 1.004 . . . . 0.0 108.557 171.141 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 80.8 p -87.58 153.3 21.5 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.004 1.721 . . . . 0.0 110.144 177.559 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 4.2 pm0 -66.52 154.58 39.98 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.696 0.798 . . . . 0.0 112.884 -178.517 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 19.8 tpt180 -68.6 119.37 12.93 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.99 0.916 . . . . 0.0 109.646 -173.152 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 75.8 ttt180 -71.4 140.86 50.29 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.136 0.575 . . . . 0.0 111.708 -172.76 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -70.17 154.29 42.1 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.58 1.152 . . . . 0.0 112.888 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 . . . . . 0 C--O 1.253 1.273 0 C-N-CA 124.999 1.32 . . . . 0.0 114.458 176.697 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 59.2 mtt . . . . . 0 N--CA 1.49 1.575 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.12 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -55.59 154.97 23.03 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 122.832 2.355 . . . . 0.0 110.284 167.751 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -58.66 109.18 0.48 Allowed 'Trans proline' 0 C--N 1.351 0.658 0 C-N-CA 123.972 3.115 . . . . 0.0 111.492 -169.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.5 t -150.2 156.16 41.08 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.487 1.115 . . . . 0.0 112.191 -169.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 82.8 t80 -145.45 118.06 8.6 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 127.419 2.288 . . . . 0.0 108.732 -175.328 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 97.8 p -140.84 161.56 53.38 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 124.808 1.243 . . . . 0.0 113.645 -168.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -67.67 161.53 78.85 Favored 'Cis proline' 0 C--N 1.355 0.886 0 CA-C-N 120.041 1.051 . . . . 0.0 111.707 -4.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.64 -24.75 67.76 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 176.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 13.5 tp -139.71 121.04 14.94 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 126.015 1.726 . . . . 0.0 108.487 171.198 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 61.3 tp -109.67 121.35 45.01 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.38 1.072 . . . . 0.0 108.591 168.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 14.3 p -109.95 126.46 67.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 123.867 0.867 . . . . 0.0 109.779 171.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 27.0 m -130.77 165.77 30.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 125.006 1.323 . . . . 0.0 111.964 176.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.3 m -89.44 147.8 23.81 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.748 1.219 . . . . 0.0 110.489 172.055 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -52.85 125.99 18.76 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.483 1.113 . . . . 0.0 111.393 174.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 91.06 -2.44 79.25 Favored Glycine 0 CA--C 1.534 1.231 0 C-N-CA 125.305 1.431 . . . . 0.0 114.75 -176.319 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -87.04 157.19 19.48 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 119.704 1.752 . . . . 0.0 112.275 175.531 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 53.6 m-20 -90.24 104.45 17.02 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.2 1.0 . . . . 0.0 110.234 178.44 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -90.27 111.87 23.21 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.843 0.857 . . . . 0.0 111.583 -171.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 25.8 m -113.61 125.13 53.83 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 118.716 0.689 . . . . 0.0 112.318 -173.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -101.89 159.59 15.21 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 127.094 2.158 . . . . 0.0 110.229 169.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.0 m -112.39 132.89 54.78 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.011 1.324 . . . . 0.0 109.847 174.149 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 43.1 t -117.51 144.4 45.11 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.765 1.626 . . . . 0.0 111.336 171.451 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 46.8 t -147.08 141.51 26.41 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.361 -0.837 . . . . 0.0 111.756 173.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -127.65 156.17 42.76 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 126.529 1.932 . . . . 0.0 113.948 -176.472 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 69.2 m -111.85 118.21 34.9 Favored 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 166.719 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -153.38 117.58 4.86 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.242 0.617 . . . . 0.0 111.722 -168.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 19.1 p -96.4 106.35 18.57 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.733 1.613 . . . . 0.0 109.648 177.504 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 33.0 t -172.64 167.16 5.44 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.016 1.726 . . . . 0.0 110.432 -174.264 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -73.94 -24.54 59.67 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.563 0.745 . . . . 0.0 111.366 168.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 5.3 t -170.28 164.39 8.94 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.271 1.828 . . . . 0.0 112.088 173.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 53.2 p90 -149.72 150.64 32.39 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.905 1.282 . . . . 0.0 111.48 174.589 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 49.1 t -96.07 128.7 47.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 C-N-CA 125.224 1.409 . . . . 0.0 107.68 173.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -112.95 122.02 46.38 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.433 1.493 . . . . 0.0 109.006 -175.166 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 11.4 m-80 -122.57 158.53 29.71 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.369 1.467 . . . . 0.0 112.788 -168.166 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 10.0 t90 -124.18 137.69 54.51 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 125.311 1.444 . . . . 0.0 112.068 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -132.99 141.09 48.11 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.786 1.234 . . . . 0.0 113.077 -176.807 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.5 ttt-85 -101.14 140.93 34.74 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.393 1.477 . . . . 0.0 108.258 168.096 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 29.8 mtp -91.98 145.92 24.15 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 119.04 0.836 . . . . 0.0 111.978 178.046 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 67.4 m -96.64 158.95 32.8 Favored Pre-proline 0 CA--C 1.549 0.906 0 C-N-CA 124.369 1.068 . . . . 0.0 112.064 174.099 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -56.57 -34.26 94.9 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 123.944 3.096 . . . . 0.0 113.654 174.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 9.6 m -77.01 18.03 0.4 Allowed 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.617 1.567 . . . . 0.0 113.529 175.82 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . 0.318 13.6 p30 58.01 21.04 7.37 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 128.263 2.625 . . . . 0.0 115.623 -176.596 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 18.7 mm100 -82.98 -178.06 6.99 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.052 0.941 . . . . 0.0 110.556 169.089 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -148.65 141.99 25.18 Favored 'General case' 0 CA--C 1.518 -0.271 0 C-N-CA 127.185 2.194 . . . . 0.0 108.546 -171.399 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -127.27 120.06 27.77 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 125.846 1.659 . . . . 0.0 109.359 -172.82 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 57.8 tttm -76.92 117.02 18.1 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.888 1.275 . . . . 0.0 110.868 -176.1 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 37.2 mt -94.45 -50.04 5.4 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.834 1.254 . . . . 0.0 112.966 -168.427 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -171.23 170.46 6.03 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.74 2.016 . . . . 0.0 110.33 -169.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.69 165.53 32.41 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.588 1.155 . . . . 0.0 112.963 -176.46 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -129.93 130.21 23.12 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 125.95 1.7 . . . . 0.0 109.268 169.009 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -57.74 149.59 32.91 Favored 'Cis proline' 0 C--N 1.351 0.67 0 CA-C-N 120.359 1.164 . . . . 0.0 112.734 -7.026 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -76.34 152.86 36.24 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.981 0.912 . . . . 0.0 113.26 -174.761 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -129.87 125.13 34.88 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.266 1.427 . . . . 0.0 110.355 173.215 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -101.7 1.89 38.01 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.144 1.378 . . . . 0.0 113.704 -178.646 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 55.1 m -105.58 -29.94 9.83 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.743 1.217 . . . . 0.0 113.44 -173.306 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 18.6 mm100 -72.72 145.36 86.95 Favored Pre-proline 0 CA--C 1.546 0.813 0 O-C-N 121.453 -0.779 . . . . 0.0 111.958 -179.624 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -79.95 0.57 9.92 Favored 'Trans proline' 0 CA--C 1.538 0.693 0 C-N-CA 123.843 3.029 . . . . 0.0 114.385 -173.335 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -85.86 -0.52 87.5 Favored Glycine 0 CA--C 1.533 1.2 0 C-N-CA 125.011 1.291 . . . . 0.0 113.773 178.552 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -69.25 147.43 51.24 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.836 1.254 . . . . 0.0 112.345 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -143.01 148.2 36.37 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.247 1.419 . . . . 0.0 111.501 175.114 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 14.9 m -68.5 -26.29 65.39 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.826 1.417 . . . . 0.0 114.826 -175.764 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 89.6 mtt180 -78.22 -48.38 15.95 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.026 0.83 . . . . 0.0 112.055 -177.491 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -85.69 122.03 29.21 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.477 1.111 . . . . 0.0 111.966 -169.448 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -140.32 140.55 35.65 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.967 1.307 . . . . 0.0 110.539 -173.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.5 t -126.52 130.87 71.77 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 124.922 1.289 . . . . 0.0 110.01 -177.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 89.7 m -130.17 127.99 40.84 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.933 1.293 . . . . 0.0 110.427 -179.121 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -79.97 140.11 36.76 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.114 0.965 . . . . 0.0 110.997 173.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 27.1 mt -97.63 159.32 31.33 Favored Pre-proline 0 CA--C 1.546 0.827 0 C-N-CA 125.056 1.342 . . . . 0.0 111.487 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -67.0 -3.68 10.11 Favored 'Trans proline' 0 CA--C 1.543 0.944 0 C-N-CA 123.681 2.921 . . . . 0.0 114.351 175.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -69.05 -8.86 49.06 Favored 'General case' 0 CA--C 1.557 1.243 0 CA-C-N 119.364 0.983 . . . . 0.0 113.277 172.445 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 90.01 -34.08 4.23 Favored Glycine 0 N--CA 1.476 1.351 0 C-N-CA 126.439 1.971 . . . . 0.0 115.971 168.484 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 78.9 mtt85 -140.06 73.61 1.43 Allowed 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.862 1.265 . . . . 0.0 109.11 169.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -165.79 136.06 3.54 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 125.649 1.58 . . . . 0.0 108.577 -171.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -146.89 131.46 17.77 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.96 0.904 . . . . 0.0 111.734 -167.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 5.0 m-70 -94.53 133.87 37.69 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.743 0.817 . . . . 0.0 110.7 169.035 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 32.1 mtt -123.44 105.31 9.69 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 126.387 1.875 . . . . 0.0 109.242 -174.433 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 7.2 t -112.83 128.91 56.57 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -169.676 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 15.2 t -92.86 90.09 2.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 106.588 -1.634 . . . . 0.0 106.588 168.33 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 72.5 t -64.84 131.34 30.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 123.451 0.7 . . . . 0.0 109.236 177.089 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 3.5 tpp180 62.81 45.78 5.5 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.786 1.235 . . . . 0.0 112.136 173.215 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.33 138.12 58.42 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.583 -0.698 . . . . 0.0 112.724 -169.457 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 51.8 mmm-85 -116.42 163.76 15.57 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 126.178 1.791 . . . . 0.0 110.39 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 33.2 mtm105 -55.39 -25.42 35.5 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 179.339 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -71.72 -18.82 62.12 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 174.617 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -79.72 -27.37 40.62 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 119.736 1.153 . . . . 0.0 112.329 177.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 50.8 m -49.47 139.79 11.53 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.822 1.249 . . . . 0.0 113.152 179.567 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 147.22 -167.15 28.47 Favored Glycine 0 N--CA 1.472 1.055 0 C-N-CA 124.535 1.064 . . . . 0.0 113.089 -174.754 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.7 m -91.93 148.17 22.41 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.996 1.318 . . . . 0.0 110.833 -177.243 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 65.7 m-85 -147.41 157.95 43.78 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.907 1.683 . . . . 0.0 112.083 -174.139 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -158.4 159.27 35.58 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.993 1.317 . . . . 0.0 113.492 175.819 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 49.7 t -104.03 148.6 26.03 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.257 1.823 . . . . 0.0 111.255 178.523 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -151.77 136.44 5.48 Favored Glycine 0 N--CA 1.474 1.179 0 C-N-CA 123.743 0.687 . . . . 0.0 114.308 177.776 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -113.84 155.68 25.27 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.74 1.216 . . . . 0.0 113.046 -176.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 18.5 tt -146.51 132.79 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 125.316 1.446 . . . . 0.0 110.436 172.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 16.4 m -72.46 161.13 31.23 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.529 1.131 . . . . 0.0 112.954 -178.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.58 -10.13 49.09 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 115.946 1.832 . . . . 0.0 115.946 -178.515 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -71.52 147.55 92.53 Favored Pre-proline 0 CA--C 1.549 0.926 0 C-N-CA 124.241 1.016 . . . . 0.0 112.303 -178.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -67.57 -21.89 45.34 Favored 'Trans proline' 0 CA--C 1.538 0.725 0 C-N-CA 122.982 2.455 . . . . 0.0 112.807 177.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -85.99 -0.82 56.45 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 124.874 1.269 . . . . 0.0 113.893 176.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.9 157.17 31.33 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.245 1.018 . . . . 0.0 113.094 -177.027 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 84.6 mt-30 -138.0 158.62 43.96 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.118 1.767 . . . . 0.0 108.916 175.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 57.9 mt -78.23 118.27 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 121.745 -0.597 . . . . 0.0 110.578 -175.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 3.8 ttmp? -94.19 131.43 39.76 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.272 1.429 . . . . 0.0 109.12 169.321 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -114.51 149.74 35.94 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.18 0.992 . . . . 0.0 112.504 -170.182 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 51.7 m -88.37 164.97 15.27 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.295 1.438 . . . . 0.0 113.132 174.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -66.7 139.52 57.84 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.566 0.746 . . . . 0.0 109.408 168.753 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.55 166.62 23.29 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 -173.879 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -142.28 169.6 17.27 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 127.227 2.211 . . . . 0.0 110.668 172.498 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -116.74 144.69 44.15 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 174.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 66.9 tp -102.67 135.91 43.44 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 127.141 2.176 . . . . 0.0 109.224 169.532 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 35.3 ttm180 -131.6 108.54 9.6 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.339 1.456 . . . . 0.0 109.503 -179.744 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 35.9 t -99.82 115.22 40.35 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 124.198 0.999 . . . . 0.0 109.064 176.604 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 82.8 p -97.03 154.88 17.05 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.891 1.676 . . . . 0.0 110.664 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -63.09 142.49 58.36 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.304 0.642 . . . . 0.0 112.455 -176.177 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 48.7 ttt85 -77.93 102.08 7.15 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 123.87 0.868 . . . . 0.0 110.826 -179.087 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.93 147.87 49.11 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.462 1.105 . . . . 0.0 112.79 -179.618 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -68.98 151.77 46.11 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.8 0.84 . . . . 0.0 112.351 174.134 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 . . . . . 0 C--O 1.253 1.284 0 C-N-CA 124.978 1.311 . . . . 0.0 113.201 177.868 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 1.7 mpt? . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 116.657 -1.64 . . . . 0.0 111.395 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -68.62 152.77 74.42 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 CA-C-N 122.247 1.838 . . . . 0.0 110.643 172.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -60.91 138.81 81.38 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 123.051 2.5 . . . . 0.0 114.986 -175.585 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.1 t -162.56 141.39 8.93 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 125.587 1.555 . . . . 0.0 111.055 169.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -120.7 114.27 21.42 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 126.079 1.752 . . . . 0.0 106.819 171.145 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 67.6 m -130.94 151.99 79.89 Favored Pre-proline 0 N--CA 1.475 0.811 0 N-CA-C 114.144 1.165 . . . . 0.0 114.144 -169.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -68.55 152.52 89.0 Favored 'Cis proline' 0 C--N 1.353 0.779 0 CA-C-N 118.79 0.604 . . . . 0.0 111.257 -4.445 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -55.94 -28.63 57.76 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 176.394 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 45.1 tp -137.16 114.46 10.88 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.46 1.504 . . . . 0.0 108.302 168.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 44.7 tp -96.74 126.62 42.03 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.96 1.304 . . . . 0.0 109.187 173.194 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.7 t -111.77 122.84 66.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 124.142 0.977 . . . . 0.0 108.472 172.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 33.6 m -126.54 167.98 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 124.347 1.059 . . . . 0.0 111.997 174.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 22.7 m -91.12 146.64 23.67 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.779 1.232 . . . . 0.0 110.128 172.188 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -52.41 120.15 5.25 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.469 1.108 . . . . 0.0 111.78 174.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 97.86 -1.58 59.71 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 126.083 1.801 . . . . 0.0 114.804 -177.342 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -89.62 155.06 19.49 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 119.556 1.678 . . . . 0.0 112.556 178.416 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 66.8 m-20 -83.21 106.08 14.71 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.012 0.925 . . . . 0.0 110.182 177.487 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -89.66 111.9 22.99 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.841 0.856 . . . . 0.0 110.872 -176.798 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 33.8 m -120.08 125.53 48.51 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.961 0.904 . . . . 0.0 111.496 -175.289 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -96.98 146.92 24.51 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 126.05 1.74 . . . . 0.0 110.684 170.014 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 88.4 m -94.17 123.92 37.86 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.003 1.321 . . . . 0.0 108.081 169.279 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 37.2 t -122.74 122.6 39.13 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.878 1.671 . . . . 0.0 109.774 -176.281 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 42.4 t -143.74 127.5 17.2 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 121.45 -0.781 . . . . 0.0 111.067 -169.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 33.6 p90 -160.59 149.88 17.2 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.472 1.509 . . . . 0.0 111.653 169.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 64.9 m -83.47 153.18 24.59 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.928 0.891 . . . . 0.0 112.278 171.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -130.26 147.29 51.97 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.353 1.461 . . . . 0.0 110.959 173.27 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 24.6 p -85.28 -17.33 37.25 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.646 1.578 . . . . 0.0 113.747 -176.608 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 18.8 p -80.93 163.96 22.95 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.94 1.696 . . . . 0.0 112.828 176.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -79.1 -18.01 54.09 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.887 1.675 . . . . 0.0 113.597 -178.039 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 25.1 m -167.48 147.97 5.35 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 126.526 1.93 . . . . 0.0 110.945 177.73 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 32.5 p90 -158.6 160.63 36.77 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.568 1.147 . . . . 0.0 112.85 -169.738 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 91.4 t -96.19 134.22 34.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 C-N-CA 126.216 1.806 . . . . 0.0 108.616 169.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -100.39 128.31 46.49 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.246 1.019 . . . . 0.0 108.427 168.842 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 28.3 m120 -120.48 157.14 30.03 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.513 1.925 . . . . 0.0 111.423 -176.076 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 17.1 t90 -135.03 143.76 46.92 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.32 1.048 . . . . 0.0 112.821 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -141.4 148.51 39.69 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.907 1.283 . . . . 0.0 114.097 -169.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 59.1 ttt85 -104.45 143.21 33.32 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.453 1.501 . . . . 0.0 108.172 167.544 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 33.8 mtp -86.49 145.07 26.96 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.354 0.979 . . . . 0.0 112.388 174.356 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 74.1 m -107.4 152.19 41.19 Favored Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 125.612 1.565 . . . . 0.0 111.478 177.096 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -68.57 -17.35 43.23 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 124.102 3.201 . . . . 0.0 113.608 -175.525 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.3 m -76.92 9.09 3.14 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.849 1.26 . . . . 0.0 113.005 171.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 58.9 t30 69.63 46.51 0.71 Allowed 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 127.402 2.281 . . . . 0.0 111.901 178.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -137.72 -172.61 3.28 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.077 1.351 . . . . 0.0 110.922 176.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.2 p -138.05 151.05 47.48 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 125.847 1.659 . . . . 0.0 110.474 -172.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -127.76 131.8 49.62 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 124.878 1.271 . . . . 0.0 111.224 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -78.44 118.84 20.98 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.316 1.447 . . . . 0.0 111.404 -172.058 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 86.1 mt -97.41 -51.12 4.27 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.773 1.229 . . . . 0.0 112.278 -170.46 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -168.51 171.32 9.04 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.748 1.619 . . . . 0.0 109.858 -174.461 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.51 163.06 35.54 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.803 1.241 . . . . 0.0 111.351 -176.276 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 38.9 t80 -138.07 116.22 9.54 Favored Pre-proline 0 CA--C 1.546 0.818 0 C-N-CA 124.032 0.933 . . . . 0.0 110.543 169.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -61.92 163.24 43.19 Favored 'Cis proline' 0 CA--C 1.539 0.765 0 CA-C-N 119.286 0.781 . . . . 0.0 111.379 -8.553 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -68.78 94.51 0.61 Allowed 'General case' 0 CA--C 1.543 0.707 0 CA-C-O 122.756 1.265 . . . . 0.0 112.373 -173.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -90.6 9.12 30.86 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 127.72 2.408 . . . . 0.0 113.369 -176.263 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 52.2 ptt85 -69.35 -29.27 67.03 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.331 1.052 . . . . 0.0 113.182 172.45 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 43.4 m 68.05 -25.16 0.13 Allowed 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 128.106 2.562 . . . . 0.0 115.573 175.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 57.8 mm-40 -135.83 164.08 45.89 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 127.055 2.142 . . . . 0.0 110.369 -176.236 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -77.07 176.38 10.2 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 123.578 2.852 . . . . 0.0 111.365 169.674 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 123.04 -11.89 8.65 Favored Glycine 0 CA--C 1.533 1.194 0 C-N-CA 124.968 1.27 . . . . 0.0 114.79 176.203 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 11.9 mp0 -86.82 147.95 25.6 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 118.191 0.995 . . . . 0.0 109.682 169.407 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -76.59 148.55 36.93 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 123.712 0.805 . . . . 0.0 113.064 -175.285 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 17.4 m -59.66 -16.33 25.67 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.53 1.532 . . . . 0.0 114.848 -178.14 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 66.2 mtt85 -52.01 -48.68 64.35 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.998 1.319 . . . . 0.0 113.792 171.585 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -83.08 132.37 35.12 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 -165.766 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -143.82 141.31 30.31 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.384 1.474 . . . . 0.0 111.746 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 89.8 t -123.72 129.1 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 C-N-CA 125.552 1.541 . . . . 0.0 109.065 170.201 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 89.0 m -129.86 131.44 46.1 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.155 1.382 . . . . 0.0 110.074 -179.255 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -82.93 135.92 34.74 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.947 0.899 . . . . 0.0 110.359 173.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 33.2 mt -88.31 163.02 38.25 Favored Pre-proline 0 CA--C 1.547 0.842 0 C-N-CA 123.569 0.748 . . . . 0.0 111.987 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.74 -22.93 38.83 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 123.996 3.131 . . . . 0.0 114.009 170.347 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 58.5 t30 -65.14 -12.19 48.3 Favored 'General case' 0 CA--C 1.555 1.173 0 C-N-CA 124.26 1.024 . . . . 0.0 113.445 175.176 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 78.25 -34.11 1.76 Allowed Glycine 0 N--CA 1.476 1.351 0 C-N-CA 127.677 2.56 . . . . 0.0 116.352 168.432 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 2.5 ppt_? -130.13 73.47 1.53 Allowed 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 123.512 1.625 . . . . 0.0 108.32 171.678 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 11.1 t0 179.76 136.91 0.11 Allowed 'General case' 0 C--O 1.238 0.485 0 C-N-CA 128.515 2.726 . . . . 0.0 108.415 -169.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -145.85 148.51 32.95 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 124.222 1.009 . . . . 0.0 112.35 -168.705 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 14.2 m170 -105.68 123.59 48.17 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.079 1.352 . . . . 0.0 111.099 169.557 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -110.96 111.3 22.33 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 126.813 2.045 . . . . 0.0 108.01 -178.106 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 8.4 t -123.7 134.3 53.73 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 115.317 1.599 . . . . 0.0 115.317 -168.248 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 25.7 t -99.33 93.57 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 126.42 1.888 . . . . 0.0 106.153 167.358 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 98.0 t -66.9 127.23 28.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 124.882 1.273 . . . . 0.0 109.536 178.439 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 68.8 ttt180 57.65 55.68 5.4 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.767 1.627 . . . . 0.0 111.653 178.747 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -72.56 140.53 48.15 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.001 0.92 . . . . 0.0 112.616 -172.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 60.6 mtp85 -129.32 168.53 16.11 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.766 1.626 . . . . 0.0 110.26 -174.345 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 51.5 mtm180 -61.84 -17.58 56.88 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 115.598 1.703 . . . . 0.0 115.598 -169.133 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -71.37 -22.84 61.84 Favored 'General case' 0 CA--C 1.553 1.064 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 169.418 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 -86.55 -13.54 45.56 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 125.377 1.471 . . . . 0.0 113.574 -176.397 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 41.4 m -55.61 137.82 48.29 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 120.986 -1.071 . . . . 0.0 111.183 169.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 151.61 -165.98 30.65 Favored Glycine 0 N--CA 1.471 0.97 0 O-C-N 121.445 -0.785 . . . . 0.0 113.504 -176.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.9 m -98.5 140.83 32.16 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.879 1.272 . . . . 0.0 110.895 -172.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -140.26 154.12 46.75 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.084 1.354 . . . . 0.0 112.568 -175.248 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.3 pp -158.35 153.99 26.32 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.944 1.298 . . . . 0.0 112.778 179.201 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 14.4 m -95.47 159.91 14.77 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.604 0.761 . . . . 0.0 112.121 172.223 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -143.8 175.26 23.82 Favored Glycine 0 CA--C 1.527 0.823 0 C-N-CA 125.35 1.452 . . . . 0.0 111.56 168.542 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -158.54 159.24 35.33 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 118.635 1.217 . . . . 0.0 113.96 -178.768 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 16.9 tt -150.22 138.94 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 125.417 1.487 . . . . 0.0 110.564 177.529 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 13.5 m -69.51 159.67 32.88 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.321 1.048 . . . . 0.0 112.668 176.39 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 40.9 mt -75.17 -11.87 60.17 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 177.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -65.59 148.78 97.93 Favored Pre-proline 0 CA--C 1.552 1.029 0 C-N-CA 124.405 1.082 . . . . 0.0 112.367 175.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -69.47 -20.19 36.55 Favored 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 123.141 2.561 . . . . 0.0 113.194 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -87.23 3.64 45.75 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.715 1.206 . . . . 0.0 113.886 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -67.31 164.56 18.18 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.871 1.268 . . . . 0.0 113.957 -175.145 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 22.1 pt20 -149.1 163.5 37.4 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.417 1.887 . . . . 0.0 109.756 176.28 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 54.8 mt -83.83 135.78 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 CA-C-O 121.554 0.693 . . . . 0.0 112.744 -171.356 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -95.99 144.67 26.08 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 127.502 2.321 . . . . 0.0 109.74 167.676 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.9 mp0 -143.03 158.82 43.24 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 126.543 1.937 . . . . 0.0 109.801 170.589 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 4.1 t -150.08 -170.35 3.62 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 175.07 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -61.5 130.68 47.17 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.13 1.772 . . . . 0.0 114.109 -169.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.73 167.18 22.31 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 115.872 1.804 . . . . 0.0 115.872 -169.881 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -123.27 169.67 11.06 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 127.33 2.252 . . . . 0.0 110.812 169.428 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -126.64 143.97 51.06 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.994 1.318 . . . . 0.0 111.846 -177.607 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 49.8 tp -114.08 136.7 52.64 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 126.354 1.861 . . . . 0.0 110.293 173.373 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 59.6 ttt85 -127.49 123.37 35.78 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 126.171 1.788 . . . . 0.0 109.944 170.629 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 44.9 t -102.96 123.57 56.45 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 124.612 1.165 . . . . 0.0 108.679 169.535 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 79.6 p -99.77 158.64 15.64 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.744 1.618 . . . . 0.0 110.882 176.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -58.52 150.85 21.69 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.421 1.088 . . . . 0.0 112.894 -178.273 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 11.9 ttm180 -69.7 126.46 29.78 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 123.695 0.798 . . . . 0.0 109.982 -174.619 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 64.0 mtt-85 -77.15 155.5 32.27 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.188 0.995 . . . . 0.0 112.624 -168.33 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -70.25 154.36 42.0 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.497 1.119 . . . . 0.0 112.509 175.637 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 . . . . . 0 C--O 1.253 1.259 0 C-N-CA 125.224 1.41 . . . . 0.0 112.965 177.267 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 33' ' ' MET . . . . . 0.587 ' N ' ' HG ' ' A' ' 57' ' ' SER . 27.8 ttt . . . . . 0 N--CA 1.488 1.437 0 CA-C-O 118.549 -0.739 . . . . 0.0 110.37 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -68.9 151.86 73.75 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 122.847 2.365 . . . . 0.0 111.216 177.395 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -68.48 123.27 10.32 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 123.469 2.779 . . . . 0.0 110.07 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 33.7 m -128.05 147.37 50.52 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.317 1.447 . . . . 0.0 109.661 -174.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -143.28 117.91 9.81 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.671 1.589 . . . . 0.0 109.043 179.694 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 88.6 p -140.94 159.89 60.36 Favored Pre-proline 0 CA--C 1.551 0.994 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 -168.398 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.3 162.51 79.31 Favored 'Cis proline' 0 C--N 1.356 0.925 0 CA-C-N 120.058 1.057 . . . . 0.0 111.912 -3.141 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.74 -24.05 67.61 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 177.487 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 47.9 tp -142.0 124.15 15.49 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 125.341 1.457 . . . . 0.0 108.658 169.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 53.7 tp -111.25 126.57 55.02 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.064 1.346 . . . . 0.0 109.255 171.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.2 t -111.51 122.57 66.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.966 0.907 . . . . 0.0 109.252 175.159 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.1 m -126.63 173.24 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 125.132 1.373 . . . . 0.0 111.342 170.015 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 99.1 m -104.84 151.79 23.4 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.49 1.516 . . . . 0.0 110.228 172.6 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -51.77 125.56 15.38 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.281 1.032 . . . . 0.0 112.562 174.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.84 -3.46 74.07 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 126.054 1.788 . . . . 0.0 114.531 -176.315 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -92.61 154.37 18.43 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 119.594 1.697 . . . . 0.0 111.523 175.033 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -85.17 127.39 34.25 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 121.505 0.669 . . . . 0.0 111.305 171.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -103.83 128.13 51.29 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.737 1.615 . . . . 0.0 110.083 178.04 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 27.7 m -128.66 127.87 43.02 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.064 0.945 . . . . 0.0 111.371 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -103.28 158.83 16.05 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.553 1.941 . . . . 0.0 110.59 170.511 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 85.5 m -101.2 134.21 44.59 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.058 1.343 . . . . 0.0 109.261 169.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 44.8 t -115.16 134.06 55.49 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.432 1.893 . . . . 0.0 110.011 170.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 66.8 m -138.69 130.34 27.63 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.194 0.997 . . . . 0.0 111.042 -173.463 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 40.9 p90 -160.6 153.01 20.59 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.494 1.518 . . . . 0.0 110.535 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.587 ' HG ' ' N ' ' A' ' 33' ' ' MET . 31.1 p -93.42 152.87 18.83 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.261 0.624 . . . . 0.0 111.042 168.58 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 -152.45 140.06 19.78 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.086 0.954 . . . . 0.0 111.625 -177.691 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 52.7 m -132.12 106.56 8.06 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.404 1.481 . . . . 0.0 108.145 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 29.6 t -177.26 169.73 2.23 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.422 1.889 . . . . 0.0 110.394 -172.155 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -76.52 -19.71 57.67 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 123.787 0.835 . . . . 0.0 112.061 168.387 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.8 m -175.52 163.5 2.96 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 127.538 2.335 . . . . 0.0 112.227 179.089 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 40.8 p90 -148.59 162.53 39.49 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.045 1.338 . . . . 0.0 111.924 -177.247 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 87.7 t -111.03 128.43 67.48 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 C-N-CA 125.612 1.565 . . . . 0.0 108.075 169.836 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 58.8 tp -106.37 134.05 50.11 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 125.243 1.417 . . . . 0.0 108.883 169.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -127.16 150.47 49.49 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.152 1.381 . . . . 0.0 110.825 178.033 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 11.7 t90 -117.62 139.99 50.24 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.473 1.109 . . . . 0.0 111.236 176.155 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -133.29 146.86 51.77 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.703 1.201 . . . . 0.0 113.626 -172.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -111.07 138.67 47.19 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.608 1.563 . . . . 0.0 108.276 168.042 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 28.3 mtp -85.05 143.62 28.77 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 118.846 0.748 . . . . 0.0 112.339 -178.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.4 m -100.43 154.05 37.41 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 125.212 1.405 . . . . 0.0 111.918 178.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.83 -30.98 79.17 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 124.442 3.428 . . . . 0.0 114.704 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.0 m -77.0 10.74 2.13 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.079 1.352 . . . . 0.0 113.593 178.454 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 66.38 43.6 2.63 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.775 2.03 . . . . 0.0 111.353 -176.316 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 -121.55 -172.73 2.48 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.551 1.541 . . . . 0.0 109.88 175.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.1 p -144.74 144.23 31.09 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.638 1.575 . . . . 0.0 110.609 -173.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -121.54 132.43 54.7 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.721 1.208 . . . . 0.0 111.347 176.565 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -77.66 128.27 33.82 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.866 1.266 . . . . 0.0 111.335 -177.334 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 60.0 mt -104.7 -44.5 4.85 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.196 1.398 . . . . 0.0 113.544 -168.511 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -171.27 174.93 4.38 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 128.085 2.554 . . . . 0.0 109.395 -174.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.6 166.57 30.45 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.314 1.046 . . . . 0.0 112.769 -170.229 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -142.89 115.25 6.03 Favored Pre-proline 0 CA--C 1.546 0.821 0 C-N-CA 125.435 1.494 . . . . 0.0 109.67 169.506 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -55.12 153.4 20.94 Favored 'Cis proline' 0 C--N 1.351 0.705 0 CA-C-N 119.941 1.015 . . . . 0.0 112.665 -10.75 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -67.63 118.59 11.12 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 123.426 0.691 . . . . 0.0 112.387 -175.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -94.48 19.24 9.96 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 126.475 1.91 . . . . 0.0 112.176 178.513 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 78.6 mtp180 -57.66 -7.87 0.77 Allowed 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 127.205 2.202 . . . . 0.0 116.616 -168.487 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 21.3 m -67.03 -22.13 65.89 Favored 'General case' 0 CA--C 1.546 0.801 0 O-C-N 121.068 -1.02 . . . . 0.0 112.691 168.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 64.5 mm-40 -88.74 143.12 31.31 Favored Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 124.454 1.102 . . . . 0.0 111.432 176.483 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -76.15 159.56 37.07 Favored 'Trans proline' 0 C--N 1.35 0.655 0 C-N-CA 123.756 2.971 . . . . 0.0 113.089 -171.584 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 101.52 -20.71 45.49 Favored Glycine 0 N--CA 1.471 1.017 0 C-N-CA 126.126 1.822 . . . . 0.0 112.062 -179.019 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -81.27 149.28 29.05 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.911 1.284 . . . . 0.0 111.204 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -142.93 144.51 32.43 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.818 1.247 . . . . 0.0 111.477 -169.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 56.0 p -67.91 -14.93 63.36 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 115.027 1.491 . . . . 0.0 115.027 -174.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 13.0 ptp180 -65.26 -24.65 67.38 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 119.305 0.957 . . . . 0.0 112.725 173.176 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -93.99 140.02 30.22 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.32 1.448 . . . . 0.0 111.339 -176.104 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -137.86 145.27 41.99 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.298 1.439 . . . . 0.0 111.123 178.927 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 58.1 t -126.54 125.23 66.87 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 125.538 1.535 . . . . 0.0 108.734 174.024 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 84.8 m -130.49 129.28 42.72 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.818 1.247 . . . . 0.0 110.655 -174.178 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.7 pm0 -76.61 141.32 41.1 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.792 1.237 . . . . 0.0 111.605 175.421 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 38.0 mt -93.92 157.82 37.34 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 123.829 0.852 . . . . 0.0 111.628 177.061 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -65.71 -3.56 8.24 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 123.551 2.834 . . . . 0.0 114.028 174.844 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -62.41 -26.14 68.33 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 119.441 1.018 . . . . 0.0 112.739 169.519 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 92.34 -15.7 61.6 Favored Glycine 0 N--CA 1.474 1.226 0 C-N-CA 125.659 1.599 . . . . 0.0 114.547 175.516 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.41 73.51 0.91 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.769 1.628 . . . . 0.0 109.995 170.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -174.64 147.43 1.06 Allowed 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 127.223 2.209 . . . . 0.0 109.054 -177.344 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 60.6 m-85 -143.62 151.29 39.96 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 114.103 1.149 . . . . 0.0 114.103 -168.325 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 13.5 m170 -110.01 139.32 45.25 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.684 1.594 . . . . 0.0 109.625 167.267 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 46.1 mtt -128.84 123.73 33.53 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.896 1.278 . . . . 0.0 109.212 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 88.9 p -130.48 139.12 50.54 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 115.739 1.755 . . . . 0.0 115.739 -168.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 15.5 t -98.11 104.02 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 125.922 1.689 . . . . 0.0 106.656 169.6 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 60.7 t -81.48 128.67 38.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 123.647 0.779 . . . . 0.0 109.868 -176.417 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 50.1 ttt85 56.23 53.62 8.7 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.224 1.41 . . . . 0.0 111.017 178.812 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.43 145.83 55.64 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.614 1.166 . . . . 0.0 112.106 -170.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 33.8 mmm-85 -118.92 168.05 11.15 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.884 1.674 . . . . 0.0 110.489 178.151 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 44.3 mtm180 -57.78 -20.54 36.08 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 120.862 -1.149 . . . . 0.0 113.738 173.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -59.57 -22.86 62.34 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.248 1.419 . . . . 0.0 113.893 168.751 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -94.92 -13.28 25.54 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.214 1.406 . . . . 0.0 114.435 -175.152 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 67.2 m -60.71 134.89 57.53 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-N 120.349 1.431 . . . . 0.0 112.616 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 155.92 -165.78 32.76 Favored Glycine 0 N--CA 1.473 1.139 0 O-C-N 121.247 -0.908 . . . . 0.0 113.571 -177.19 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.0 m -95.98 139.61 31.93 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.501 1.12 . . . . 0.0 110.747 -177.356 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 61.3 m-85 -137.41 156.39 48.25 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.074 1.75 . . . . 0.0 112.558 -176.358 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -161.96 147.85 13.39 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.797 1.639 . . . . 0.0 112.134 176.319 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 24.7 p -94.46 159.16 15.23 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.698 0.799 . . . . 0.0 112.655 169.677 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -148.07 131.48 3.84 Favored Glycine 0 CA--C 1.529 0.91 0 C-N-CA 124.766 1.174 . . . . 0.0 112.639 173.248 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -115.11 147.41 40.26 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.563 1.145 . . . . 0.0 112.634 -176.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 18.6 tt -148.14 136.38 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 125.189 1.396 . . . . 0.0 111.007 178.333 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 31.5 m -72.15 155.38 40.32 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 121.101 -0.999 . . . . 0.0 111.853 174.608 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.68 -10.78 58.34 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 115.775 1.769 . . . . 0.0 115.775 -174.708 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -75.27 140.63 73.0 Favored Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 124.137 0.975 . . . . 0.0 111.935 179.262 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -55.28 -23.43 37.39 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 123.875 3.05 . . . . 0.0 114.797 174.38 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -71.2 -13.91 62.08 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 124.968 1.307 . . . . 0.0 114.099 177.617 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -74.73 161.47 29.6 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.24 1.416 . . . . 0.0 113.839 -176.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 28.5 mp0 -132.41 156.99 45.68 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.379 1.872 . . . . 0.0 108.573 170.755 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 33.7 mt -75.91 116.38 18.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 O-C-N 121.731 -0.606 . . . . 0.0 109.98 178.645 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.3 88.47 4.94 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.026 0.93 . . . . 0.0 109.358 169.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -77.38 131.32 37.99 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.466 1.106 . . . . 0.0 110.911 179.466 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 76.8 p -81.42 166.91 19.97 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 115.333 1.605 . . . . 0.0 115.333 -174.021 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 10.1 mp -67.29 114.5 6.05 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.103 0.961 . . . . 0.0 109.271 171.258 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.06 150.89 44.44 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -173.025 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -131.83 169.65 15.95 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 126.422 1.889 . . . . 0.0 112.442 178.251 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -110.89 139.66 46.03 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.078 1.351 . . . . 0.0 112.333 -177.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 59.6 tp -109.0 128.02 54.58 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 126.063 1.745 . . . . 0.0 108.938 168.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -118.77 117.01 27.74 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.494 1.518 . . . . 0.0 109.53 173.185 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 34.9 t -102.58 117.83 48.55 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 C-N-CA 124.347 1.059 . . . . 0.0 108.563 169.561 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 81.6 p -95.96 156.95 16.12 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.895 1.678 . . . . 0.0 111.304 -178.676 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -59.05 142.32 51.65 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.45 1.1 . . . . 0.0 113.224 -171.502 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -67.42 118.12 10.32 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 172.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 32.7 ptt-85 -139.78 167.61 21.71 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.418 1.087 . . . . 0.0 112.638 -168.145 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -72.75 154.31 40.73 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.526 1.13 . . . . 0.0 112.433 175.425 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 . . . . . 0 C--O 1.254 1.327 0 C-N-CA 125.224 1.41 . . . . 0.0 113.001 177.1 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 10.7 tpt . . . . . 0 N--CA 1.488 1.463 0 CA-C-O 117.822 -1.085 . . . . 0.0 110.06 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -59.39 -49.59 10.31 Favored 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 123.339 2.693 . . . . 0.0 115.068 -177.213 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -79.69 162.37 24.35 Favored 'Trans proline' 0 C--N 1.355 0.918 0 C-N-CA 122.37 2.047 . . . . 0.0 111.881 170.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 6.4 t -154.73 163.23 40.56 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.091 0.957 . . . . 0.0 112.206 173.727 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -148.07 116.74 6.66 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.997 2.119 . . . . 0.0 109.232 -175.454 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 73.0 m -140.82 160.65 57.77 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 124.621 1.168 . . . . 0.0 113.17 -169.77 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -71.53 156.34 97.09 Favored 'Cis proline' 0 C--N 1.352 0.75 0 CA-C-N 119.535 0.87 . . . . 0.0 111.305 -5.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.44 -20.09 64.16 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 176.029 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 36.2 tp -141.9 120.16 12.25 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.642 1.577 . . . . 0.0 108.874 169.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 62.1 tp -109.92 122.36 47.36 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.156 1.382 . . . . 0.0 108.98 169.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.2 t -106.25 123.8 61.2 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 172.724 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.5 m -128.05 176.23 8.1 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 124.828 1.251 . . . . 0.0 111.092 171.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 52.7 m -110.12 151.5 27.16 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.605 1.562 . . . . 0.0 110.519 175.096 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -54.33 125.16 18.26 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.906 1.282 . . . . 0.0 112.201 178.549 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 97.3 -9.16 64.97 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 127.224 2.345 . . . . 0.0 114.301 -174.569 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -81.38 160.53 24.07 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 119.927 1.863 . . . . 0.0 112.547 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -91.88 111.34 22.84 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.473 1.109 . . . . 0.0 109.302 172.514 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -96.52 118.64 33.45 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.098 0.959 . . . . 0.0 111.143 -175.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 28.5 m -123.08 125.26 44.86 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.566 0.746 . . . . 0.0 112.13 -173.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -101.76 159.55 15.23 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.909 1.683 . . . . 0.0 110.755 169.554 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 21.0 m -110.67 128.91 55.89 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.179 1.392 . . . . 0.0 110.037 174.354 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 42.5 t -115.06 150.89 35.2 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.916 1.687 . . . . 0.0 111.67 171.407 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 62.0 p -148.28 143.86 27.23 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.254 -0.904 . . . . 0.0 111.362 169.503 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.438 ' CD2' ' HB3' ' A' ' 125' ' ' ALA . 3.3 m-85 -130.84 156.2 45.42 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 126.251 1.82 . . . . 0.0 114.677 -176.665 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.6 t -133.9 133.63 41.7 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.486 1.515 . . . . 0.0 108.671 168.251 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -133.88 151.87 51.67 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.042 1.337 . . . . 0.0 111.664 -171.204 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 16.6 m -72.01 -34.92 69.24 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.439 1.496 . . . . 0.0 112.95 -173.544 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 5.3 t -97.64 -171.15 2.12 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.003 0.921 . . . . 0.0 113.234 -178.111 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -71.02 -20.3 62.41 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.638 1.575 . . . . 0.0 115.083 -168.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 8.5 t -167.14 173.5 9.05 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.375 1.47 . . . . 0.0 111.345 -175.642 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 55.0 p90 -159.51 154.74 25.25 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.783 1.233 . . . . 0.0 113.204 -175.507 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 75.9 t -96.12 133.72 36.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 C-N-CA 125.636 1.574 . . . . 0.0 107.302 168.597 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.451 HD22 ' CG ' ' A' ' 106' ' ' PHE . 5.5 tp -99.3 147.6 25.02 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.714 1.206 . . . . 0.0 110.123 174.143 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 23.0 m120 -136.21 154.3 50.97 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.745 1.618 . . . . 0.0 111.382 -176.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 12.6 t90 -129.84 137.9 50.7 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.425 1.09 . . . . 0.0 111.787 177.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -134.02 145.73 49.72 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 -174.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 56.7 ttt85 -101.92 142.03 33.85 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.26 1.424 . . . . 0.0 107.883 166.77 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 29.6 mtp -88.25 144.34 26.5 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 118.657 0.662 . . . . 0.0 112.54 175.183 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 74.3 m -106.45 149.47 38.35 Favored Pre-proline 0 CA--C 1.545 0.755 0 C-N-CA 125.43 1.492 . . . . 0.0 111.161 173.629 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -68.37 -15.86 42.73 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 124.016 3.144 . . . . 0.0 114.013 -173.28 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 18.4 m -76.94 8.96 3.24 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.813 1.245 . . . . 0.0 113.027 172.051 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 58.1 t30 70.53 45.75 0.59 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 127.693 2.397 . . . . 0.0 111.507 -177.555 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -128.93 -179.53 5.15 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.56 1.544 . . . . 0.0 110.368 -179.404 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.7 p -142.2 152.52 43.21 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 126.02 1.728 . . . . 0.0 110.503 -175.405 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -131.05 131.89 44.57 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.515 1.126 . . . . 0.0 111.177 174.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -77.69 121.23 23.72 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.473 1.109 . . . . 0.0 110.89 -178.125 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 48.0 mt -94.27 -45.01 7.69 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.476 1.51 . . . . 0.0 111.82 -173.031 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -168.35 175.64 6.29 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.497 1.919 . . . . 0.0 110.565 -171.059 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -158.41 165.8 33.78 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.435 1.494 . . . . 0.0 111.57 -175.319 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -153.06 117.11 2.82 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 124.233 1.013 . . . . 0.0 111.39 172.782 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.75 154.33 23.49 Favored 'Cis proline' 0 C--N 1.35 0.63 0 CA-C-N 119.665 0.916 . . . . 0.0 111.981 -12.463 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -72.59 94.65 1.73 Allowed 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 121.841 0.829 . . . . 0.0 111.091 178.141 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -78.58 -2.0 36.78 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.816 1.646 . . . . 0.0 114.249 -177.258 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.8 ptm180 -75.51 5.35 6.02 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.65 1.98 . . . . 0.0 115.082 -177.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.7 t 81.9 -42.45 0.15 Allowed 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 128.446 2.698 . . . . 0.0 113.134 175.406 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -109.33 109.51 60.33 Favored Pre-proline 0 CA--C 1.545 0.782 0 C-N-CA 124.781 1.233 . . . . 0.0 109.972 176.685 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -88.63 140.3 4.28 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 123.767 2.978 . . . . 0.0 111.754 -173.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 85.08 16.26 65.35 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 125.135 1.35 . . . . 0.0 113.257 170.697 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -71.48 -34.54 70.27 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 117.781 0.79 . . . . 0.0 113.043 -169.595 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -93.89 131.46 39.29 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.697 1.199 . . . . 0.0 110.914 172.431 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 54.2 p -90.57 -16.69 28.29 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 114.497 1.295 . . . . 0.0 114.497 -176.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 35.2 mtp-105 -97.07 -44.64 6.89 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.329 1.051 . . . . 0.0 113.187 -169.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 99.6 m-85 -97.52 116.25 29.37 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.856 1.263 . . . . 0.0 109.908 -178.756 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -130.37 141.25 50.57 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.714 1.205 . . . . 0.0 111.332 -172.462 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 47.5 t -126.53 125.93 68.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 C-N-CA 125.085 1.354 . . . . 0.0 109.706 178.537 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 87.3 m -130.54 131.29 44.98 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.925 1.29 . . . . 0.0 110.674 -176.327 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -79.66 140.76 36.94 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.923 0.889 . . . . 0.0 111.91 176.517 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 27.1 mt -95.1 157.1 37.05 Favored Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 125.586 1.554 . . . . 0.0 111.67 178.436 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -70.76 -2.76 11.41 Favored 'Trans proline' 0 CA--C 1.542 0.915 0 C-N-CA 123.619 2.88 . . . . 0.0 114.177 175.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -70.24 -8.95 54.17 Favored 'General case' 0 CA--C 1.555 1.141 0 N-CA-C 114.109 1.152 . . . . 0.0 114.109 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 108.03 -33.95 5.94 Favored Glycine 0 N--CA 1.476 1.336 0 C-N-CA 125.903 1.716 . . . . 0.0 116.443 168.567 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.49 73.28 0.9 Allowed 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.453 1.627 . . . . 0.0 110.224 169.599 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -157.45 142.37 16.79 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 125.171 1.389 . . . . 0.0 109.34 -167.323 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' PHE . . . . . 0.451 ' CG ' HD22 ' A' ' 65' ' ' LEU . 31.3 m-85 -149.45 135.17 18.65 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.056 0.542 . . . . 0.0 111.724 -169.089 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -90.99 136.25 33.2 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.022 0.929 . . . . 0.0 111.129 169.224 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 32.9 mtt -121.22 106.03 11.12 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 126.063 1.745 . . . . 0.0 109.38 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 33.8 t -110.98 128.88 55.98 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.257 1.023 . . . . 0.0 113.416 -169.346 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 28.2 t -96.88 100.85 11.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 C-N-CA 125.865 1.666 . . . . 0.0 106.61 168.051 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 89.0 t -73.96 129.23 36.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 124.09 0.956 . . . . 0.0 109.924 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 60.57 57.02 2.88 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.137 1.375 . . . . 0.0 110.967 173.577 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.78 156.31 39.46 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.338 1.055 . . . . 0.0 113.211 -171.68 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 23.6 mtm180 -133.66 160.68 36.81 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 126.533 1.933 . . . . 0.0 109.716 -168.341 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 32.2 mtp85 -55.65 -27.49 50.15 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 120.03 1.286 . . . . 0.0 113.258 171.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -69.89 -20.67 63.37 Favored 'General case' 0 CA--C 1.553 1.084 0 N-CA-C 114.476 1.287 . . . . 0.0 114.476 172.585 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -83.24 -9.81 58.92 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 121.061 -1.024 . . . . 0.0 112.879 175.025 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 71.2 m -59.88 135.6 57.75 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 120.211 -1.555 . . . . 0.0 111.634 173.816 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 160.27 -172.75 36.77 Favored Glycine 0 CA--C 1.53 1.028 0 C-N-CA 124.529 1.062 . . . . 0.0 113.365 -179.604 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.0 m -91.13 140.92 29.36 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.802 0.841 . . . . 0.0 109.985 176.27 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 52.9 m-85 -133.82 160.17 38.44 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.232 1.813 . . . . 0.0 110.632 178.639 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -155.99 149.54 24.85 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 124.299 1.04 . . . . 0.0 112.684 175.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 36.7 t -89.57 158.64 17.56 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.149 1.38 . . . . 0.0 111.054 173.532 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -149.32 170.43 29.59 Favored Glycine 0 N--CA 1.471 1.026 0 C-N-CA 125.634 1.587 . . . . 0.0 112.282 174.134 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' ALA . . . . . 0.438 ' HB3' ' CD2' ' A' ' 56' ' ' PHE . . . -156.68 159.21 38.17 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 173.608 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 21.0 tt -140.8 135.6 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 125.846 1.658 . . . . 0.0 109.934 174.253 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 19.9 m -69.31 160.79 30.59 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.515 0.726 . . . . 0.0 112.821 -179.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.53 -15.88 63.73 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 115.421 1.637 . . . . 0.0 115.421 -173.518 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -78.68 149.09 74.06 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 124.776 1.23 . . . . 0.0 112.445 -177.253 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -67.68 -22.48 43.73 Favored 'Trans proline' 0 CA--C 1.54 0.775 0 C-N-CA 123.125 2.55 . . . . 0.0 113.09 -179.638 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -79.19 -2.95 43.34 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 114.687 1.365 . . . . 0.0 114.687 176.199 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.46 167.71 16.07 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.769 1.228 . . . . 0.0 113.319 -178.283 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 22.3 pt20 -146.8 161.3 40.96 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.207 1.803 . . . . 0.0 109.312 173.671 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 20.9 mt -77.65 118.9 25.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 O-C-N 121.609 -0.682 . . . . 0.0 111.126 -174.665 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -89.76 128.14 36.07 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.313 1.445 . . . . 0.0 109.426 168.591 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -87.12 145.39 26.46 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.347 1.059 . . . . 0.0 110.861 178.64 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 5.8 t -94.36 -166.8 1.55 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.44 1.096 . . . . 0.0 112.237 172.001 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -68.02 153.01 44.64 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.33 1.452 . . . . 0.0 111.676 174.603 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 25.7 mtp-105 -91.15 146.51 23.77 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 125.346 1.458 . . . . 0.0 110.906 172.298 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -143.0 150.03 39.09 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.269 1.427 . . . . 0.0 111.837 178.653 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -93.0 132.49 37.04 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.599 1.16 . . . . 0.0 111.818 177.064 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 48.1 tp -103.63 126.33 50.71 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 166.151 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 33.6 ttm180 -128.38 109.94 11.89 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 124.342 1.057 . . . . 0.0 109.01 -178.476 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 21.8 t -102.32 119.53 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 123.872 0.869 . . . . 0.0 108.727 178.041 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 70.1 p -93.36 147.72 22.68 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 126.064 1.746 . . . . 0.0 109.887 178.12 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 10.6 pm0 -57.43 150.23 19.02 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.741 0.817 . . . . 0.0 112.592 -179.515 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 47.2 ttt85 -64.93 116.55 6.49 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 124.079 0.952 . . . . 0.0 110.918 -168.312 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 18.6 ptp180 -71.09 157.73 37.69 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.995 0.918 . . . . 0.0 113.37 -169.145 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -70.71 154.36 41.93 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.346 1.058 . . . . 0.0 112.367 174.238 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 . . . . . 0 C--O 1.252 1.196 0 C-N-CA 125.07 1.348 . . . . 0.0 113.314 177.772 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 97.0 mmm . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 118.354 -0.831 . . . . 0.0 110.762 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_exo -58.4 -46.38 24.92 Favored 'Trans proline' 0 CA--C 1.545 1.027 0 C-N-CA 123.688 2.925 . . . . 0.0 116.137 -177.434 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -81.69 160.26 19.09 Favored 'Trans proline' 0 C--N 1.356 0.966 0 C-N-CA 122.374 2.05 . . . . 0.0 112.158 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.2 t -158.58 158.13 33.31 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.359 1.063 . . . . 0.0 112.126 176.394 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -144.97 115.31 7.56 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 126.415 1.886 . . . . 0.0 108.493 175.109 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 93.3 p -140.88 159.31 62.72 Favored Pre-proline 0 CA--C 1.55 0.954 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 -168.741 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -69.84 161.6 86.1 Favored 'Cis proline' 0 C--N 1.354 0.867 0 CA-C-N 119.488 0.853 . . . . 0.0 111.6 -6.088 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.68 -24.49 67.8 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.148 0.795 . . . . 0.0 113.148 176.096 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 46.4 tp -141.0 121.26 13.89 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.639 1.576 . . . . 0.0 108.784 169.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 57.0 tp -107.17 125.45 51.11 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.241 1.417 . . . . 0.0 109.078 171.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.4 t -109.61 123.54 65.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.089 0.956 . . . . 0.0 108.702 173.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 26.8 m -127.42 164.38 28.53 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 124.707 1.203 . . . . 0.0 111.451 172.513 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 51.9 m -90.66 149.43 22.09 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.272 1.029 . . . . 0.0 110.451 171.656 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -56.98 123.66 15.93 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.117 0.967 . . . . 0.0 111.834 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 87.92 3.53 79.83 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 126.106 1.812 . . . . 0.0 114.569 -175.735 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -92.27 157.6 16.57 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.487 1.644 . . . . 0.0 111.569 170.685 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -82.45 130.37 35.09 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.187 0.995 . . . . 0.0 110.635 177.681 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -112.9 124.72 53.25 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.787 1.235 . . . . 0.0 111.099 -178.007 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 28.4 m -129.76 125.4 35.75 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 119.184 0.902 . . . . 0.0 112.078 -176.437 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -100.41 151.26 21.74 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.697 1.599 . . . . 0.0 110.621 169.564 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 58.0 m -99.54 130.39 45.78 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.292 1.437 . . . . 0.0 109.112 173.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 44.5 t -125.06 143.51 50.88 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 126.242 1.817 . . . . 0.0 111.496 177.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 96.3 p -153.97 156.82 38.16 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.103 -0.998 . . . . 0.0 113.131 168.661 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -143.39 156.19 44.61 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.846 2.058 . . . . 0.0 111.25 178.607 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.6 t -84.6 101.44 12.13 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 166.682 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -124.8 145.36 49.79 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.483 1.513 . . . . 0.0 110.77 -177.713 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 24.0 m -57.17 139.26 53.11 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.66 1.584 . . . . 0.0 110.724 179.476 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.2 m -68.75 -2.23 8.85 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 115.184 1.55 . . . . 0.0 115.184 -172.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -78.2 -70.74 0.47 Allowed 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.179 1.392 . . . . 0.0 111.428 -178.514 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 82.2 p -171.38 150.64 2.91 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.515 1.126 . . . . 0.0 113.631 -176.669 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 34.7 p90 -169.11 164.36 11.22 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.191 1.796 . . . . 0.0 111.84 -176.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 21.4 t -107.83 134.1 50.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 125.848 1.659 . . . . 0.0 109.027 169.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -104.53 141.08 37.02 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.648 1.179 . . . . 0.0 109.282 168.546 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -137.7 158.04 45.2 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.471 1.508 . . . . 0.0 111.182 -170.876 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 10.0 t90 -129.09 138.02 51.59 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.417 1.087 . . . . 0.0 112.187 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -131.19 141.41 50.05 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.247 1.419 . . . . 0.0 112.977 -175.752 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 48.7 ttp180 -101.11 143.98 30.56 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.936 2.094 . . . . 0.0 108.718 169.233 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 36.8 mtp -93.65 141.86 28.0 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.854 0.752 . . . . 0.0 112.398 178.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.0 m -92.21 158.49 39.06 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 124.849 1.26 . . . . 0.0 111.709 175.228 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_exo -55.81 -33.44 88.2 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 123.949 3.099 . . . . 0.0 114.192 177.398 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 12.6 m -77.03 8.28 4.03 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.201 1.4 . . . . 0.0 113.821 177.044 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 60.3 t30 70.19 22.84 5.38 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 127.279 2.232 . . . . 0.0 113.259 -178.281 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 45.4 mt-30 -90.14 -176.73 4.95 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.423 1.089 . . . . 0.0 110.364 169.857 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.6 p -138.3 152.18 48.28 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.515 1.526 . . . . 0.0 111.165 -175.316 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -132.58 129.33 38.86 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 126.505 1.922 . . . . 0.0 110.155 -176.551 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 44.9 tttm -85.76 121.5 28.51 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.194 0.998 . . . . 0.0 111.252 -171.396 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 53.5 mt -97.6 -48.69 5.15 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.914 1.285 . . . . 0.0 113.124 -168.769 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -170.66 172.68 5.71 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.88 1.672 . . . . 0.0 110.972 -172.629 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.59 165.49 32.7 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.993 1.317 . . . . 0.0 112.629 -177.47 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -140.63 121.0 8.86 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 125.684 1.594 . . . . 0.0 109.822 170.169 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.23 154.16 17.59 Favored 'Cis proline' 0 C--N 1.351 0.694 0 CA-C-N 120.065 1.059 . . . . 0.0 112.96 -9.404 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -65.55 111.8 3.3 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.954 0.883 . . . . 0.0 112.739 -171.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -89.53 7.41 36.39 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.723 2.009 . . . . 0.0 112.882 177.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -55.54 -11.2 0.81 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 126.993 2.117 . . . . 0.0 116.458 -170.219 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 20.3 m -62.46 -25.22 67.87 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.628 1.171 . . . . 0.0 112.649 168.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -83.71 123.15 76.54 Favored Pre-proline 0 CA--C 1.549 0.923 0 CA-C-O 118.173 -0.918 . . . . 0.0 109.507 169.626 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -58.35 155.79 33.78 Favored 'Trans proline' 0 C--N 1.356 0.935 0 C-N-CA 124.239 3.293 . . . . 0.0 115.53 -173.721 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 102.04 -19.97 47.19 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 126.043 1.782 . . . . 0.0 112.036 -179.297 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -89.42 141.27 28.71 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.963 1.305 . . . . 0.0 111.282 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -143.05 176.86 8.77 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 114.474 1.287 . . . . 0.0 114.474 -172.613 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 50.7 p -83.99 -20.06 33.46 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 115.638 1.718 . . . . 0.0 115.638 -174.688 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 44.0 mtp-105 -69.26 -36.88 77.58 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 120.063 1.301 . . . . 0.0 111.995 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -92.46 130.4 38.14 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.978 1.311 . . . . 0.0 108.56 173.412 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -131.06 152.15 50.67 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.083 1.353 . . . . 0.0 111.374 -177.249 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 97.4 t -126.61 123.21 62.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 125.534 1.533 . . . . 0.0 108.88 175.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 95.8 m -122.77 126.95 48.47 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.326 1.05 . . . . 0.0 110.787 -177.616 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 3.2 tp-100 -76.18 134.72 39.83 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.645 1.578 . . . . 0.0 109.989 171.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 33.3 mt -90.29 164.39 27.62 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 124.054 0.942 . . . . 0.0 112.004 176.145 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -55.37 -21.28 28.93 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 123.872 3.048 . . . . 0.0 114.172 172.058 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -60.19 -26.16 66.14 Favored 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 176.622 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 89.84 -17.25 53.99 Favored Glycine 0 CA--C 1.535 1.32 0 C-N-CA 125.355 1.455 . . . . 0.0 114.602 173.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 5.3 ptt180 -152.44 73.54 1.03 Allowed 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 123.024 1.393 . . . . 0.0 109.178 169.313 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -169.92 137.54 1.65 Allowed 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 128.322 2.649 . . . . 0.0 107.304 -179.081 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -141.58 145.44 35.07 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 114.46 1.282 . . . . 0.0 114.46 -166.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 -102.53 121.22 41.94 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.044 1.338 . . . . 0.0 110.506 168.731 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -101.29 103.85 14.84 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 126.467 1.907 . . . . 0.0 107.948 176.369 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 14.8 m -114.52 121.88 44.84 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 114.136 1.162 . . . . 0.0 114.136 -167.37 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 12.8 t -88.59 118.04 33.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 C-N-CA 125.084 1.354 . . . . 0.0 107.509 168.228 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 98.0 t -78.86 117.31 24.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 124.25 1.02 . . . . 0.0 109.21 173.461 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 55.6 mtp180 48.37 76.92 0.11 Allowed 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 126.787 2.035 . . . . 0.0 111.876 178.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -69.77 138.17 52.53 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.422 1.089 . . . . 0.0 111.891 -176.523 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.78 161.16 17.88 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 126.235 1.814 . . . . 0.0 110.195 178.342 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 76.9 mtm180 -56.76 -23.07 40.28 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 114.387 1.255 . . . . 0.0 114.387 -178.51 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -65.16 -23.6 67.15 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 170.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -82.13 -16.84 48.52 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.226 1.01 . . . . 0.0 113.365 -178.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 49.8 m -59.59 134.67 57.23 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 119.743 1.156 . . . . 0.0 112.693 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 152.68 -169.12 31.75 Favored Glycine 0 N--CA 1.472 1.086 0 C-N-CA 124.812 1.196 . . . . 0.0 113.249 -174.119 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.0 m -93.12 147.49 22.82 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.314 1.046 . . . . 0.0 111.146 -178.066 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -141.52 159.49 42.1 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.804 2.041 . . . . 0.0 111.5 -177.626 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.0 pp -154.34 154.1 32.77 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.618 1.567 . . . . 0.0 111.152 172.447 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 29.5 p -102.13 157.7 16.7 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.305 0.642 . . . . 0.0 112.566 171.313 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -149.06 145.16 13.17 Favored Glycine 0 N--CA 1.472 1.075 0 C-N-CA 124.997 1.284 . . . . 0.0 113.89 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -125.38 159.26 32.25 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.971 1.309 . . . . 0.0 113.04 -173.667 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 16.9 tt -159.5 137.57 2.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 125.332 1.453 . . . . 0.0 111.176 178.78 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 17.8 m -70.92 161.45 31.03 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.143 0.977 . . . . 0.0 112.664 175.059 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 17.8 mt -77.04 -12.56 59.95 Favored 'General case' 0 N--CA 1.479 0.994 0 O-C-N 120.69 -1.256 . . . . 0.0 114.335 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -65.82 143.83 98.65 Favored Pre-proline 0 CA--C 1.552 1.041 0 C-N-CA 124.046 0.939 . . . . 0.0 112.377 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_exo -55.58 -27.67 61.21 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 123.782 2.988 . . . . 0.0 114.695 176.442 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -83.24 -1.61 53.56 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.719 1.208 . . . . 0.0 114.218 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -67.94 162.77 23.59 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.366 1.066 . . . . 0.0 113.474 -177.57 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.27 153.21 38.4 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.812 1.645 . . . . 0.0 108.814 178.004 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 64.9 mt -76.53 124.75 35.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 123.631 0.773 . . . . 0.0 111.828 -173.528 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -97.11 145.46 25.98 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.695 1.198 . . . . 0.0 108.116 165.534 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -130.16 148.96 52.05 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.461 1.028 . . . . 0.0 111.818 -179.059 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 4.9 t -94.51 -166.11 1.42 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.011 1.325 . . . . 0.0 113.126 -173.054 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 82.8 mt -64.68 155.3 33.93 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.615 1.566 . . . . 0.0 111.734 175.542 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 31.0 mtp-105 -89.38 139.22 30.73 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.548 1.139 . . . . 0.0 110.444 173.043 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -137.11 151.01 48.37 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.413 1.485 . . . . 0.0 111.419 178.238 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -103.85 137.76 41.4 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.428 1.091 . . . . 0.0 111.754 -177.273 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 63.1 tp -106.14 128.97 54.27 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 125.747 1.619 . . . . 0.0 108.905 169.041 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 71.4 ttt180 -120.52 118.24 29.71 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.516 1.527 . . . . 0.0 109.399 171.268 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 32.8 t -102.17 119.44 50.48 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 C-N-CA 124.494 1.118 . . . . 0.0 108.432 170.21 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 63.0 p -99.66 144.77 28.36 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.526 1.531 . . . . 0.0 110.078 179.489 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -62.82 145.07 55.86 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.795 -0.566 . . . . 0.0 112.459 -174.431 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 46.9 ttt85 -79.75 99.68 7.57 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.196 0.999 . . . . 0.0 110.857 -171.476 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -76.33 161.41 28.75 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.012 1.325 . . . . 0.0 113.077 -178.234 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -71.57 154.35 41.51 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.523 1.129 . . . . 0.0 112.489 175.286 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 . . . . . 0 C--O 1.253 1.242 0 C-N-CA 125.313 1.445 . . . . 0.0 112.6 176.475 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 33' ' ' MET . . . . . 0.559 ' N ' ' HG ' ' A' ' 57' ' ' SER . 55.8 tpp . . . . . 0 N--CA 1.486 1.374 0 CA-C-O 118.916 -0.564 . . . . 0.0 110.61 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -71.42 162.74 41.38 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 122.752 2.301 . . . . 0.0 110.501 170.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -52.19 131.69 40.58 Favored 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 123.571 2.847 . . . . 0.0 113.558 177.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.0 t -159.3 141.85 13.94 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 126.269 1.828 . . . . 0.0 109.957 173.206 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.407 ' CD1' ' SG ' ' A' ' 123' ' ' CYS . 1.4 m-85 -127.39 141.95 51.55 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.143 0.977 . . . . 0.0 112.048 -168.202 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 95.9 p -141.08 159.39 61.89 Favored Pre-proline 0 CA--C 1.548 0.9 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 177.474 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -73.15 161.54 93.69 Favored 'Cis proline' 0 C--N 1.353 0.802 0 CA-C-N 118.925 0.652 . . . . 0.0 111.096 -11.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.5 -29.44 70.55 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 171.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 49.1 tp -140.53 121.93 15.01 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.82 1.648 . . . . 0.0 109.453 171.014 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 56.5 tp -104.81 126.68 52.13 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.74 1.616 . . . . 0.0 109.068 171.348 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 18.3 t -110.18 125.45 67.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 123.999 0.92 . . . . 0.0 108.533 171.58 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.1 m -129.47 165.14 30.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 124.671 1.188 . . . . 0.0 111.653 174.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 88.5 m -92.12 148.6 22.05 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.295 1.038 . . . . 0.0 109.849 171.353 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -56.23 123.8 15.78 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.987 0.915 . . . . 0.0 112.076 -177.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 93.58 -2.98 71.03 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 125.421 1.486 . . . . 0.0 114.74 -175.443 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -71.16 153.24 42.65 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.624 1.712 . . . . 0.0 111.461 169.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -84.28 106.53 15.97 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 169.063 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -94.25 123.18 37.49 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.863 0.865 . . . . 0.0 110.928 -172.047 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 42.0 m -131.63 126.83 35.69 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 119.051 0.841 . . . . 0.0 112.313 -170.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -98.29 156.74 16.57 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 126.139 1.776 . . . . 0.0 110.506 170.513 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.8 m -105.64 129.74 53.82 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.834 1.254 . . . . 0.0 109.18 171.431 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 67.8 m -115.84 124.4 50.59 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.58 1.152 . . . . 0.0 109.104 169.46 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 73.1 m -121.55 126.37 49.0 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 124.748 1.219 . . . . 0.0 110.075 -170.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 10.9 p90 -160.53 156.3 25.61 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.961 1.304 . . . . 0.0 110.583 177.237 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.559 ' HG ' ' N ' ' A' ' 33' ' ' MET . 63.1 m -83.26 114.65 21.53 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.26 -0.9 . . . . 0.0 110.074 177.291 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 11.5 m-20 -67.58 146.61 53.72 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.813 1.245 . . . . 0.0 111.534 -175.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 62.2 p -77.12 152.57 34.88 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.083 0.953 . . . . 0.0 111.514 -178.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 24.6 m -77.47 -24.29 50.24 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 177.041 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -90.31 -32.7 16.4 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.406 1.083 . . . . 0.0 112.949 -174.713 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 8.6 t 128.96 165.17 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 131.416 3.886 . . . . 0.0 112.168 175.357 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 53.1 p90 -157.12 169.0 25.78 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.022 1.729 . . . . 0.0 112.283 -168.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 17.6 t -125.42 133.68 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 125.744 1.617 . . . . 0.0 107.786 168.314 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -105.89 136.17 46.02 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.138 1.375 . . . . 0.0 108.913 173.552 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -126.82 150.96 48.92 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.119 1.367 . . . . 0.0 111.502 178.355 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 14.0 t90 -127.59 138.93 53.01 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.242 1.417 . . . . 0.0 111.847 178.406 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -134.74 151.31 50.88 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.612 1.565 . . . . 0.0 113.815 -171.171 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -112.08 141.19 46.07 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.556 1.542 . . . . 0.0 109.328 168.433 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 84.5 mmm -73.79 137.73 44.06 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.473 0.709 . . . . 0.0 111.642 174.752 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 67.7 m -94.26 156.6 38.68 Favored Pre-proline 0 CA--C 1.548 0.882 0 C-N-CA 124.723 1.209 . . . . 0.0 111.57 170.668 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -55.65 -32.74 84.76 Favored 'Trans proline' 0 C--N 1.354 0.857 0 C-N-CA 124.038 3.159 . . . . 0.0 114.648 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.3 m -76.99 5.73 7.52 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.804 1.241 . . . . 0.0 113.835 178.113 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 72.93 21.01 3.38 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 127.843 2.457 . . . . 0.0 112.98 -175.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -90.41 -175.08 4.36 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.589 1.156 . . . . 0.0 110.314 170.031 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.9 p -139.02 145.26 39.42 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 125.618 1.567 . . . . 0.0 110.024 -175.582 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -121.27 131.48 54.24 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.165 0.986 . . . . 0.0 111.193 176.27 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -80.97 123.07 28.03 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.237 1.415 . . . . 0.0 110.773 -175.012 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 45.5 mt -100.94 -53.54 3.02 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.864 1.266 . . . . 0.0 112.2 -168.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -161.16 167.28 26.46 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.273 1.829 . . . . 0.0 110.014 -169.588 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.63 166.85 29.8 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.974 0.91 . . . . 0.0 112.292 -172.513 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 74.1 t80 -144.99 114.57 4.99 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 124.511 1.124 . . . . 0.0 110.558 170.467 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -55.71 154.05 23.41 Favored 'Cis proline' 0 C--N 1.351 0.671 0 CA-C-N 119.772 0.954 . . . . 0.0 112.567 -11.339 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -68.17 110.76 4.15 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.74 0.781 . . . . 0.0 112.134 -177.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -83.83 -8.16 59.28 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.797 1.639 . . . . 0.0 113.468 176.191 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 39.3 ptt180 -90.85 10.38 26.46 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 126.789 2.035 . . . . 0.0 114.668 -174.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 44.7 m -74.6 58.15 0.77 Allowed 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 125.841 1.656 . . . . 0.0 113.771 -173.613 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 61.5 mm-40 -129.95 160.88 62.97 Favored Pre-proline 0 CA--C 1.547 0.859 0 C-N-CA 127.3 2.24 . . . . 0.0 109.492 176.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -52.26 138.63 55.03 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 123.701 2.934 . . . . 0.0 113.554 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 85.93 42.79 6.61 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 123.902 0.763 . . . . 0.0 112.96 -174.465 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -67.44 149.83 49.72 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.464 1.106 . . . . 0.0 112.387 -177.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -82.12 150.76 27.3 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.001 1.32 . . . . 0.0 112.741 173.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 9.1 t -110.03 -25.1 10.42 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.01 1.324 . . . . 0.0 114.132 176.502 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -76.84 -46.71 23.75 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 121.009 -1.057 . . . . 0.0 113.63 -170.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -95.8 140.94 29.86 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.427 1.091 . . . . 0.0 112.161 -168.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 58.9 ttt180 -144.54 147.27 33.01 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.11 1.364 . . . . 0.0 112.081 176.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 84.7 t -115.72 126.74 73.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 126.176 1.791 . . . . 0.0 108.763 170.265 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 98.5 m -130.51 132.29 45.55 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.361 1.464 . . . . 0.0 110.39 -177.276 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -77.68 138.47 39.09 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.09 0.556 . . . . 0.0 110.231 172.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 20.2 mt -76.85 156.44 82.55 Favored Pre-proline 0 CA--C 1.544 0.743 0 O-C-N 121.704 -0.622 . . . . 0.0 111.788 171.339 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -66.46 -6.4 15.03 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.504 2.802 . . . . 0.0 113.44 172.202 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -60.04 -26.09 65.85 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 124.086 0.955 . . . . 0.0 112.98 169.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 88.28 -10.58 70.69 Favored Glycine 0 CA--C 1.534 1.246 0 C-N-CA 125.079 1.323 . . . . 0.0 115.041 178.176 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 32.6 ptt180 -154.58 73.61 0.91 Allowed 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 118.76 1.28 . . . . 0.0 111.533 173.448 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -178.76 148.37 0.42 Allowed 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 128.157 2.583 . . . . 0.0 108.912 -177.388 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -138.01 146.6 43.27 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.793 0.837 . . . . 0.0 112.925 -177.099 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 6.6 m170 -109.2 131.26 55.24 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.033 1.733 . . . . 0.0 111.537 169.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -114.06 105.1 12.81 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 126.706 2.002 . . . . 0.0 107.762 -176.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 38.2 p -115.1 133.14 56.3 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 -168.131 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 15.4 t -96.25 104.71 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 126.772 2.029 . . . . 0.0 106.91 168.615 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 95.8 t -74.52 114.8 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 124.537 1.135 . . . . 0.0 108.742 177.861 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 10.1 mpt_? 55.34 84.96 0.07 Allowed 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 126.257 1.823 . . . . 0.0 111.317 -173.407 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -73.76 118.23 16.46 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.744 0.817 . . . . 0.0 111.213 178.472 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 9.4 mpt_? -85.82 159.86 19.61 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.41 1.484 . . . . 0.0 109.383 171.422 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 17.1 mmm180 -49.2 -39.17 28.53 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 120.937 -1.102 . . . . 0.0 113.011 172.516 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -67.36 -10.07 47.55 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 178.011 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -84.6 -8.45 58.89 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 120.107 1.321 . . . . 0.0 112.871 172.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.4 m -64.35 136.69 57.38 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 120.155 -1.59 . . . . 0.0 112.438 177.321 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 155.24 -166.74 32.72 Favored Glycine 0 N--CA 1.468 0.786 0 C-N-CA 124.101 0.858 . . . . 0.0 113.016 -178.462 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.0 m -97.26 140.42 31.77 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.525 1.13 . . . . 0.0 110.803 -176.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -135.73 163.0 31.17 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.3 1.84 . . . . 0.0 112.175 -177.717 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -162.13 146.62 12.46 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.568 1.547 . . . . 0.0 112.589 171.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' CYS . . . . . 0.407 ' SG ' ' CD1' ' A' ' 37' ' ' PHE . 1.8 p -108.54 170.69 7.86 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.038 1.735 . . . . 0.0 111.026 176.247 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -175.35 142.37 6.16 Favored Glycine 0 N--CA 1.471 1.026 0 O-C-N 121.237 -0.915 . . . . 0.0 114.184 177.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -109.73 148.2 31.84 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.567 1.147 . . . . 0.0 112.765 -176.74 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 21.3 tt -138.01 143.7 32.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 126.667 1.987 . . . . 0.0 110.078 177.125 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.7 m -67.5 161.56 25.2 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.871 0.868 . . . . 0.0 112.835 176.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -59.02 -25.74 63.94 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 115.223 1.564 . . . . 0.0 115.223 178.038 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -81.73 148.13 60.76 Favored Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 124.876 1.27 . . . . 0.0 112.52 -174.328 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -69.91 -24.97 28.4 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 123.261 2.64 . . . . 0.0 114.107 -171.776 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.3 -0.97 30.89 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.84 1.422 . . . . 0.0 114.84 178.517 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.79 173.95 5.71 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.512 1.525 . . . . 0.0 113.196 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 53.8 tp60 -134.99 143.84 47.05 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.114 1.766 . . . . 0.0 109.171 179.041 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 53.7 mt -72.45 114.84 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 170.419 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -85.13 112.74 20.96 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.396 1.079 . . . . 0.0 111.027 -178.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -90.67 158.88 16.68 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.033 1.733 . . . . 0.0 112.048 -177.126 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 4.9 t -145.98 -166.85 2.57 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.994 0.918 . . . . 0.0 111.799 169.397 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.88 136.55 57.03 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.727 1.211 . . . . 0.0 113.094 -172.685 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 80.0 mtt85 -72.43 146.33 47.03 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.709 0.804 . . . . 0.0 111.529 -177.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -120.78 135.58 55.12 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.064 1.745 . . . . 0.0 110.688 -176.187 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -104.42 139.28 39.59 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.341 1.056 . . . . 0.0 111.728 -175.644 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 52.5 tp -109.62 127.91 54.86 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.8 1.64 . . . . 0.0 109.659 171.132 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 60.7 ttt85 -118.25 119.29 34.21 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.678 1.591 . . . . 0.0 109.179 170.127 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 43.6 t -102.0 123.15 55.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 171.083 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 68.6 p -99.0 145.47 27.04 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.566 1.546 . . . . 0.0 109.208 175.713 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -66.43 141.81 57.8 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 121.54 -0.725 . . . . 0.0 111.754 -175.242 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -87.05 126.37 34.71 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.186 0.994 . . . . 0.0 110.598 -179.033 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 75.3 ttt180 -72.48 142.15 48.57 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.039 0.936 . . . . 0.0 111.438 -178.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -70.14 154.34 42.04 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.502 1.121 . . . . 0.0 112.828 177.466 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 . . . . . 0 C--O 1.254 1.322 0 C-N-CA 124.964 1.306 . . . . 0.0 114.496 176.837 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 19.0 mmt . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 118.363 -0.827 . . . . 0.0 110.79 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo -56.7 -47.77 21.97 Favored 'Trans proline' 0 CA--C 1.545 1.067 0 C-N-CA 123.602 2.868 . . . . 0.0 114.21 170.405 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -76.46 157.36 36.66 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 122.4 2.067 . . . . 0.0 112.105 170.171 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 15.3 t -164.66 152.76 12.13 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 125.203 1.401 . . . . 0.0 111.639 174.155 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.408 ' CE1' ' HB2' ' A' ' 123' ' ' CYS . 1.9 m-85 -125.0 136.61 53.89 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.405 1.482 . . . . 0.0 110.714 -169.926 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 88.7 p -140.96 157.24 67.72 Favored Pre-proline 0 CA--C 1.548 0.894 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 177.639 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -70.37 160.59 89.59 Favored 'Cis proline' 0 C--N 1.352 0.716 0 CA-C-N 119.0 0.679 . . . . 0.0 110.887 -11.532 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.46 -30.71 69.84 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 172.284 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 49.8 tp -140.32 120.68 14.0 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.569 1.548 . . . . 0.0 109.358 171.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 61.0 tp -102.83 127.02 50.17 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.45 1.5 . . . . 0.0 109.171 172.129 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.6 t -109.7 124.9 66.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 123.902 0.881 . . . . 0.0 108.811 171.703 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.2 m -127.17 169.91 17.88 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 124.639 1.176 . . . . 0.0 111.551 172.875 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 94.5 m -100.66 147.28 26.16 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.043 1.337 . . . . 0.0 110.058 173.101 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -59.27 126.6 28.33 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.178 0.991 . . . . 0.0 111.823 -174.678 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 91.65 -2.84 77.7 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 125.993 1.759 . . . . 0.0 114.473 -174.091 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 38.3 t0 -83.35 156.84 22.8 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.841 1.821 . . . . 0.0 112.004 173.267 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -79.21 123.75 27.7 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.567 0.747 . . . . 0.0 109.806 170.175 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -102.66 129.4 49.24 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 117.68 -1.152 . . . . 0.0 110.567 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 31.3 m -132.79 129.65 38.84 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 119.377 0.99 . . . . 0.0 112.222 -177.386 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -106.21 159.62 15.96 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 127.625 2.37 . . . . 0.0 110.731 169.823 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 85.9 m -109.76 134.72 51.7 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.5 1.52 . . . . 0.0 109.108 170.706 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 64.2 m -131.55 125.74 33.09 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.981 1.312 . . . . 0.0 110.237 172.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 91.2 p -104.29 148.17 26.67 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.099 0.96 . . . . 0.0 110.817 175.415 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -145.23 151.19 38.0 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 124.852 1.261 . . . . 0.0 112.347 178.056 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.0 t -153.79 143.1 21.49 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.727 0.811 . . . . 0.0 110.799 168.59 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 62.9 m-80 -135.92 162.85 31.68 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.878 1.671 . . . . 0.0 110.648 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 21.3 p -68.25 -26.26 65.6 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.108 1.363 . . . . 0.0 112.901 178.734 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 23.5 p -81.54 161.29 23.64 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.205 1.802 . . . . 0.0 112.194 169.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -70.45 -24.6 62.92 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.636 1.574 . . . . 0.0 113.044 -175.483 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.6 t -156.96 164.13 38.36 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.156 1.382 . . . . 0.0 111.684 -174.189 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 35.0 p90 -162.88 166.15 24.34 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.973 1.709 . . . . 0.0 111.318 -169.366 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 50.6 t -95.87 124.34 48.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 N-CA-C 107.559 -1.274 . . . . 0.0 107.559 170.262 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.58 HD11 ' HE1' ' A' ' 108' ' ' MET . 2.2 tm? -99.33 141.76 31.68 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 126.655 1.982 . . . . 0.0 108.896 177.831 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -141.96 154.91 45.39 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.932 1.693 . . . . 0.0 111.258 -175.581 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 20.3 t90 -128.2 143.0 51.0 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.944 1.298 . . . . 0.0 111.395 175.34 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -138.13 148.3 44.79 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.818 1.247 . . . . 0.0 114.164 -170.356 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 53.5 ttt-85 -109.19 143.19 38.93 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.234 1.414 . . . . 0.0 109.65 168.765 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 85.7 mmm -75.38 135.07 40.82 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 118.333 0.515 . . . . 0.0 111.368 173.913 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.2 p -85.7 165.64 34.06 Favored Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 123.478 0.711 . . . . 0.0 112.429 172.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -58.62 -28.31 85.65 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 123.45 2.767 . . . . 0.0 113.498 170.726 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.7 m -83.52 0.96 44.24 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.874 1.27 . . . . 0.0 113.277 175.792 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 74.05 21.71 2.51 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 127.613 2.365 . . . . 0.0 113.429 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 18.7 mm100 -87.42 -178.96 6.28 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.71 0.804 . . . . 0.0 110.393 169.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.8 p -126.83 119.35 26.62 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.94 1.696 . . . . 0.0 109.388 -173.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -104.07 128.62 51.7 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.717 0.807 . . . . 0.0 111.199 -179.09 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -76.53 127.62 33.18 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.045 0.938 . . . . 0.0 112.065 -172.269 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 66.2 mt -106.75 -44.35 4.47 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 125.343 1.457 . . . . 0.0 112.406 -169.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -166.97 169.71 12.75 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.479 1.912 . . . . 0.0 110.432 -176.1 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.56 165.77 32.18 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.645 1.178 . . . . 0.0 112.76 -171.134 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 75.0 t80 -147.49 123.0 5.29 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 125.388 1.475 . . . . 0.0 110.533 170.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -55.65 144.73 19.24 Favored 'Cis proline' 0 C--N 1.351 0.665 0 CA-C-N 120.126 1.081 . . . . 0.0 111.94 -10.68 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -82.72 150.07 26.93 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-O 121.539 0.685 . . . . 0.0 112.567 -176.004 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -152.78 38.93 0.53 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.52 1.528 . . . . 0.0 110.731 -177.384 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.3 mmm180 -63.89 -6.97 6.83 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 115.97 1.841 . . . . 0.0 115.97 -168.378 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 36.4 p -68.77 -9.49 51.12 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.491 1.117 . . . . 0.0 113.713 169.461 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -61.26 163.65 10.35 Favored Pre-proline 0 CA--C 1.551 0.982 0 C-N-CA 124.393 1.077 . . . . 0.0 112.701 169.479 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.8 135.8 71.32 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 122.918 2.412 . . . . 0.0 110.638 168.116 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 89.26 36.03 7.77 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 123.502 0.572 . . . . 0.0 112.454 -169.479 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -69.88 126.12 28.75 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.184 1.394 . . . . 0.0 110.853 176.811 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -143.02 145.98 33.42 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.004 1.321 . . . . 0.0 111.744 174.065 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 51.9 m -109.7 -7.4 15.08 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 -179.273 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 48.5 mtp180 -84.61 -32.95 23.45 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.672 1.189 . . . . 0.0 112.567 179.709 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -88.63 142.38 27.74 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.368 1.067 . . . . 0.0 111.388 176.617 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 48.6 mtm180 -143.0 154.16 43.71 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.054 1.341 . . . . 0.0 112.79 -172.018 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 37.6 t -126.49 134.05 67.25 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 126.392 1.877 . . . . 0.0 108.702 168.136 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 95.3 m -123.91 126.06 45.71 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.262 1.425 . . . . 0.0 108.666 169.325 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 6.8 pm0 -83.62 141.56 31.45 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.322 1.049 . . . . 0.0 111.146 174.85 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 18.1 mt -87.81 156.25 52.72 Favored Pre-proline 0 CA--C 1.542 0.668 0 C-N-CA 123.685 0.794 . . . . 0.0 111.526 178.698 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -66.43 -4.61 11.05 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 123.361 2.708 . . . . 0.0 114.148 176.163 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -71.83 -10.5 59.87 Favored 'General case' 0 CA--C 1.551 1.015 0 CA-C-N 119.895 1.225 . . . . 0.0 113.281 171.829 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 92.15 -19.43 49.58 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 125.775 1.655 . . . . 0.0 116.024 169.285 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 11.9 ptp180 -154.63 73.65 0.91 Allowed 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 122.736 1.255 . . . . 0.0 110.842 173.237 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -167.43 144.77 4.53 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 128.7 2.8 . . . . 0.0 107.834 -176.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -146.66 147.52 31.11 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 113.82 1.044 . . . . 0.0 113.82 -168.3 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 51.6 m170 -109.0 127.93 54.51 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.827 1.651 . . . . 0.0 109.758 168.196 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.58 ' HE1' HD11 ' A' ' 65' ' ' LEU . 1.1 mpt? -113.52 126.74 55.65 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 126.253 1.821 . . . . 0.0 108.592 -176.933 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 93.7 p -142.67 149.06 38.38 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 116.841 2.163 . . . . 0.0 116.841 -171.207 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 11.1 t -103.41 122.44 55.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 126.849 2.059 . . . . 0.0 108.684 174.278 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 86.3 t -73.59 120.98 23.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 124.382 1.073 . . . . 0.0 109.675 169.718 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 49.3 72.61 0.29 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 126.006 1.722 . . . . 0.0 111.807 172.353 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.58 135.4 52.85 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.367 1.067 . . . . 0.0 111.954 -172.692 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -102.88 157.8 16.72 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 126.312 1.845 . . . . 0.0 109.937 175.514 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 74.9 mtm180 -52.47 -30.39 29.59 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 175.388 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 32.1 t30 -63.14 -24.74 68.03 Favored 'General case' 0 CA--C 1.551 1.009 0 N-CA-C 114.927 1.455 . . . . 0.0 114.927 173.672 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -74.82 -21.19 59.42 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 119.811 1.187 . . . . 0.0 112.87 -179.11 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 17.6 m -57.65 131.86 51.53 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.552 1.141 . . . . 0.0 113.198 -175.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 156.64 -165.92 33.17 Favored Glycine 0 CA--C 1.529 0.961 0 C-N-CA 124.523 1.059 . . . . 0.0 113.157 -172.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.4 m -93.25 143.01 26.68 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.058 1.343 . . . . 0.0 111.139 -175.284 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 61.9 m-85 -140.81 157.3 45.59 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.702 1.601 . . . . 0.0 111.515 -177.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.6 pp -154.98 156.24 35.65 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.285 1.034 . . . . 0.0 111.857 173.437 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' CYS . . . . . 0.408 ' HB2' ' CE1' ' A' ' 37' ' ' PHE . 79.6 m -101.77 162.38 12.95 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.002 0.921 . . . . 0.0 110.741 173.539 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -155.11 158.83 28.65 Favored Glycine 0 N--CA 1.47 0.929 0 O-C-N 121.473 -0.767 . . . . 0.0 112.98 173.314 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -146.98 156.7 43.26 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 117.952 0.876 . . . . 0.0 112.766 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.0 tt -146.98 134.39 14.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 124.829 1.252 . . . . 0.0 110.983 -175.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 48.2 t -61.84 158.18 16.52 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.045 0.938 . . . . 0.0 113.068 178.666 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 68.4 mt -72.95 -12.61 61.01 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.26 1.024 . . . . 0.0 112.949 176.687 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -67.43 143.95 97.56 Favored Pre-proline 0 CA--C 1.554 1.1 0 C-N-CA 124.451 1.1 . . . . 0.0 112.583 177.755 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_exo -57.33 -30.77 88.94 Favored 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 123.624 2.883 . . . . 0.0 114.846 177.11 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -87.93 7.23 31.89 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 124.687 1.195 . . . . 0.0 114.163 -176.751 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.78 165.99 14.06 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.928 1.291 . . . . 0.0 114.319 -175.085 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 31.2 tt0 -146.49 149.88 34.5 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.215 1.806 . . . . 0.0 109.116 178.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 56.1 mt -73.39 124.64 30.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 123.377 0.671 . . . . 0.0 111.112 -176.002 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -84.81 142.99 29.38 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.037 1.735 . . . . 0.0 110.904 172.645 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -142.79 158.89 43.18 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.978 1.711 . . . . 0.0 110.638 -175.325 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 5.5 t -144.12 -171.57 3.59 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.424 1.09 . . . . 0.0 111.947 175.421 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -63.25 125.23 23.42 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.182 1.393 . . . . 0.0 110.585 -176.732 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -65.56 163.77 15.48 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 -173.15 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.96 168.21 10.27 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.021 2.129 . . . . 0.0 111.317 175.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -131.52 142.95 50.06 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.883 1.273 . . . . 0.0 111.623 177.602 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 66.1 tp -109.87 133.81 52.75 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 125.954 1.701 . . . . 0.0 109.883 170.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 72.0 ttt180 -123.94 120.14 31.64 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.676 1.59 . . . . 0.0 108.986 169.055 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 44.4 t -104.19 120.34 54.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 170.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 67.2 p -98.22 148.75 23.28 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.234 1.814 . . . . 0.0 109.521 177.452 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -64.02 151.01 44.07 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.313 -0.867 . . . . 0.0 113.226 -172.332 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 48.3 ttt85 -73.36 125.0 26.84 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 123.953 0.901 . . . . 0.0 108.638 -173.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 33.7 ptt-85 -143.22 159.78 41.68 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.966 0.906 . . . . 0.0 113.153 -167.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -73.36 154.28 40.14 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.846 1.258 . . . . 0.0 112.589 175.799 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 . . . . . 0 C--O 1.255 1.365 0 C-N-CA 125.24 1.416 . . . . 0.0 113.359 175.83 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 33' ' ' MET . . . . . 0.51 ' N ' ' HG ' ' A' ' 57' ' ' SER . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.408 0 CA-C-O 118.806 -0.616 . . . . 0.0 110.453 . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.12 147.68 67.5 Favored 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 122.768 2.312 . . . . 0.0 109.878 172.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -68.11 119.16 6.17 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 123.8 3.0 . . . . 0.0 111.462 -169.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 6.0 t -166.63 171.12 11.96 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.296 1.438 . . . . 0.0 111.44 -174.825 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.46 ' CD2' ' HB2' ' A' ' 123' ' ' CYS . 0.9 OUTLIER -160.28 157.86 28.82 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 125.943 1.697 . . . . 0.0 113.243 176.708 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 95.1 p -140.78 158.74 64.72 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 125.163 1.385 . . . . 0.0 112.568 174.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -73.48 160.88 95.18 Favored 'Cis proline' 0 C--N 1.351 0.686 0 CA-C-N 118.485 0.495 . . . . 0.0 111.311 -9.38 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.75 -30.58 71.59 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 171.511 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 45.9 tp -136.79 117.67 14.17 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.947 1.699 . . . . 0.0 109.046 171.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.2 tp -100.69 127.36 47.12 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.43 1.492 . . . . 0.0 109.439 174.029 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.0 t -109.99 124.2 66.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 123.979 0.911 . . . . 0.0 108.809 172.699 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.4 m -127.86 167.06 23.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 124.916 1.286 . . . . 0.0 111.595 172.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 67.1 m -93.4 148.49 22.02 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.485 1.114 . . . . 0.0 110.145 174.624 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -53.93 119.9 5.64 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.885 1.274 . . . . 0.0 111.708 177.359 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 94.59 -3.28 68.22 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 126.104 1.812 . . . . 0.0 114.886 -177.679 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -88.83 155.18 19.7 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 119.281 1.54 . . . . 0.0 111.582 174.544 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -80.82 134.61 35.81 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.292 -0.88 . . . . 0.0 111.437 173.198 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -107.22 131.75 53.83 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.13 1.772 . . . . 0.0 110.592 178.38 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 28.6 m -132.75 125.09 29.37 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.846 0.858 . . . . 0.0 111.302 -179.056 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -101.49 153.23 19.89 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.249 1.42 . . . . 0.0 110.357 169.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 66.9 m -117.05 117.67 30.27 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.213 1.005 . . . . 0.0 110.166 178.744 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 21.6 m -101.0 151.12 22.16 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.699 1.2 . . . . 0.0 113.157 169.652 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 70.3 m -127.05 115.42 19.17 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.01 1.324 . . . . 0.0 109.207 174.613 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -144.13 152.73 41.33 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 126.291 1.837 . . . . 0.0 110.083 -178.27 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.51 ' HG ' ' N ' ' A' ' 33' ' ' MET . 78.6 p -153.52 148.15 26.25 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.368 1.067 . . . . 0.0 111.463 169.785 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 55.3 m-80 -136.86 -174.05 3.61 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.417 1.487 . . . . 0.0 110.982 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 70.8 p -68.49 168.69 12.29 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.673 1.589 . . . . 0.0 112.794 -176.862 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.5 m -60.8 -9.4 4.01 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.712 1.605 . . . . 0.0 114.649 -179.525 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 38.4 mm-40 -67.22 -20.37 65.68 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 124.709 1.204 . . . . 0.0 112.643 170.735 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.6 t 84.76 166.84 0.09 Allowed 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 127.982 2.513 . . . . 0.0 113.126 176.195 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 24.4 p90 -154.27 159.31 41.22 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 -170.568 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 45.7 t -110.85 134.0 54.53 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 C-N-CA 127.076 2.15 . . . . 0.0 107.847 171.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 30.8 tp -109.17 134.14 52.11 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.324 0.65 . . . . 0.0 110.087 169.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -124.96 148.98 48.13 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.505 1.522 . . . . 0.0 111.241 -169.339 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 34.6 t-105 -110.22 138.83 46.07 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.4 1.48 . . . . 0.0 111.665 175.39 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -132.99 146.03 51.4 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.1 1.36 . . . . 0.0 112.441 -177.07 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 38.5 ttp180 -91.7 136.59 33.02 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.693 1.597 . . . . 0.0 107.541 167.271 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 16.6 ttm -111.44 133.14 53.95 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.972 1.309 . . . . 0.0 110.206 -179.168 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 51.0 m -85.62 160.61 53.07 Favored Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 125.301 1.44 . . . . 0.0 112.391 179.046 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_exo -58.56 -26.39 78.46 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 124.237 3.291 . . . . 0.0 114.136 174.36 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.9 p -76.95 1.32 18.06 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.891 1.677 . . . . 0.0 113.643 174.621 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 30.5 m-80 69.81 20.98 6.59 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 127.635 2.374 . . . . 0.0 112.786 -176.022 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -85.84 169.85 12.94 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.637 0.775 . . . . 0.0 110.364 169.768 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.7 p -138.92 152.48 47.77 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.967 1.307 . . . . 0.0 111.974 -173.597 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -136.9 131.11 32.66 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.362 1.865 . . . . 0.0 110.296 -178.786 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -85.05 129.27 34.83 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.16 0.984 . . . . 0.0 111.96 -173.592 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 55.5 mt -107.44 -57.1 2.13 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.282 1.033 . . . . 0.0 110.892 -172.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -162.18 173.84 13.73 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.526 1.13 . . . . 0.0 111.286 -173.216 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.62 172.17 18.28 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.104 1.361 . . . . 0.0 111.639 -177.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 45.6 t80 -138.46 118.36 9.79 Favored Pre-proline 0 CA--C 1.546 0.791 0 CA-C-O 118.507 -0.759 . . . . 0.0 110.521 168.264 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -59.14 144.98 32.5 Favored 'Cis proline' 0 C--N 1.353 0.768 0 CA-C-N 119.375 0.813 . . . . 0.0 111.153 -8.8 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -74.06 138.14 43.82 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -168.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -97.69 18.98 14.37 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.989 1.715 . . . . 0.0 112.526 -174.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 28.8 mmm180 -64.4 -48.42 75.46 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.587 1.155 . . . . 0.0 112.161 -176.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 42.8 m 59.78 19.01 7.83 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 125.75 1.62 . . . . 0.0 115.351 169.445 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -135.87 149.96 70.19 Favored Pre-proline 0 CA--C 1.543 0.71 0 C-N-CA 125.345 1.458 . . . . 0.0 112.052 -169.839 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -54.58 132.03 49.03 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 123.528 2.819 . . . . 0.0 111.48 170.351 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 82.6 -9.13 59.88 Favored Glycine 0 CA--C 1.534 1.258 0 CA-C-O 118.403 -1.22 . . . . 0.0 114.413 -176.757 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 56.84 -101.11 0.12 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 127.135 2.174 . . . . 0.0 112.171 171.13 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -142.98 145.13 32.68 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.383 1.873 . . . . 0.0 109.812 167.828 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.9 p -86.0 -17.22 35.89 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 115.26 1.578 . . . . 0.0 115.26 -177.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.3 ptm180 -153.63 -18.01 0.14 Allowed 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 116.72 2.119 . . . . 0.0 116.72 -169.523 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -103.63 117.23 33.93 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.831 1.252 . . . . 0.0 109.751 176.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 15.8 mmt180 -144.43 155.51 43.78 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.697 0.799 . . . . 0.0 112.277 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 31.1 t -126.56 140.39 49.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 C-N-CA 125.085 1.354 . . . . 0.0 110.582 176.771 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 96.3 m -130.63 134.28 46.84 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 125.474 1.509 . . . . 0.0 111.098 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -78.79 135.33 37.06 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.997 1.319 . . . . 0.0 109.967 169.519 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 21.5 mt -82.11 159.29 65.63 Favored Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 124.187 0.995 . . . . 0.0 112.386 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -64.2 -6.89 12.39 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 123.301 2.667 . . . . 0.0 114.287 174.631 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -73.85 -7.65 53.03 Favored 'General case' 0 CA--C 1.551 1.017 0 CA-C-N 120.022 1.283 . . . . 0.0 113.261 170.009 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 83.49 -14.07 43.03 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 125.518 1.532 . . . . 0.0 116.092 169.428 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.57 73.52 0.91 Allowed 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 123.103 1.43 . . . . 0.0 111.341 172.085 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -171.47 145.41 2.08 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 128.482 2.713 . . . . 0.0 108.186 -176.356 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -142.96 141.68 31.48 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -168.823 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 23.0 m170 -102.57 130.34 49.4 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.598 1.559 . . . . 0.0 110.806 169.024 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -114.77 111.54 21.4 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.974 1.71 . . . . 0.0 108.621 179.351 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 32.4 m -110.37 130.46 55.55 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.623 1.169 . . . . 0.0 112.935 -168.611 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 34.0 t -110.47 101.41 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 126.889 2.076 . . . . 0.0 107.112 168.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 70.9 t -74.32 133.87 30.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 123.785 0.834 . . . . 0.0 110.266 -178.361 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 39.1 ttm180 57.2 62.84 2.06 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.911 1.284 . . . . 0.0 110.737 172.522 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.41 135.38 47.22 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 124.475 1.11 . . . . 0.0 111.173 -175.731 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.98 167.31 10.49 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.29 1.436 . . . . 0.0 111.026 175.336 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 12.2 mtp180 -58.86 -23.02 60.26 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 113.915 1.079 . . . . 0.0 113.915 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -69.34 -21.98 63.79 Favored 'General case' 0 CA--C 1.553 1.07 0 N-CA-C 114.104 1.15 . . . . 0.0 114.104 170.501 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -77.23 -20.12 55.68 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 119.771 1.169 . . . . 0.0 113.565 174.904 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 49.1 m -57.29 129.22 40.8 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 119.86 1.209 . . . . 0.0 112.358 -178.063 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 154.55 -166.71 32.35 Favored Glycine 0 N--CA 1.471 0.991 0 C-N-CA 124.218 0.913 . . . . 0.0 113.421 -171.561 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.3 m -91.01 143.64 26.5 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.436 1.094 . . . . 0.0 110.998 -175.678 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -140.73 158.06 44.52 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.637 1.975 . . . . 0.0 110.619 176.253 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.4 pp -158.03 166.48 32.43 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 120.839 -1.163 . . . . 0.0 113.466 -178.7 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' CYS . . . . . 0.46 ' HB2' ' CD2' ' A' ' 37' ' ' PHE . 0.1 OUTLIER -114.19 135.89 53.55 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.226 1.81 . . . . 0.0 110.697 -174.585 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -138.99 130.37 4.83 Favored Glycine 0 N--CA 1.472 1.072 0 C-N-CA 123.997 0.808 . . . . 0.0 113.276 179.186 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -102.72 155.07 18.56 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.75 1.22 . . . . 0.0 112.725 -176.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 19.2 tt -155.93 144.52 12.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 125.339 1.455 . . . . 0.0 109.57 176.135 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 2.2 m -65.27 161.58 19.15 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 121.045 -1.035 . . . . 0.0 112.971 178.505 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 59.2 tp -60.58 -34.66 74.52 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.112 0.965 . . . . 0.0 112.154 169.647 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -66.83 127.88 93.64 Favored Pre-proline 0 CA--C 1.554 1.133 0 C-N-CA 124.481 1.112 . . . . 0.0 111.891 178.295 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -56.69 -24.59 55.59 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 124.108 3.205 . . . . 0.0 115.834 -178.744 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -70.6 -6.45 36.75 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 178.799 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.06 173.23 5.69 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.458 1.503 . . . . 0.0 114.103 -178.594 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -140.5 161.77 36.93 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.215 1.806 . . . . 0.0 109.668 174.481 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 28.4 mt -82.7 124.36 39.31 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 CA-C-O 121.174 0.511 . . . . 0.0 111.44 -169.787 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -91.41 127.31 36.8 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.342 1.857 . . . . 0.0 110.178 171.86 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -137.25 139.1 40.76 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.101 1.36 . . . . 0.0 111.041 -178.074 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 57.5 m -147.74 143.51 27.62 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.812 1.645 . . . . 0.0 110.063 171.303 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 42.6 mt 66.84 -178.55 0.21 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 126.978 2.111 . . . . 0.0 113.526 176.176 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.4 145.73 20.63 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.243 1.817 . . . . 0.0 110.572 169.656 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.86 165.09 13.48 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.829 1.652 . . . . 0.0 110.897 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -127.35 136.09 51.41 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 124.392 1.077 . . . . 0.0 110.23 -171.3 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 62.5 tp -110.36 131.89 54.66 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 125.554 1.541 . . . . 0.0 109.598 174.117 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 70.8 ttt180 -122.86 120.97 35.06 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.717 1.607 . . . . 0.0 109.566 170.743 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 28.7 t -104.41 118.22 51.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 C-N-CA 124.429 1.092 . . . . 0.0 109.026 170.155 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 71.9 p -98.5 155.71 17.13 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.738 1.615 . . . . 0.0 110.935 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -64.45 141.24 58.84 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 121.61 0.719 . . . . 0.0 112.347 -177.219 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 26.0 ttp-105 -80.62 123.48 28.18 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.133 1.373 . . . . 0.0 110.166 179.279 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 34.3 ttp180 -74.39 149.07 40.67 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.764 0.826 . . . . 0.0 111.749 -177.287 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -66.55 154.24 40.9 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 123.664 0.786 . . . . 0.0 110.572 167.268 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 . . . . . 0 C--O 1.252 1.221 0 C-N-CA 125.703 1.601 . . . . 0.0 114.196 -174.988 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 21.8 mmt . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 116.481 -1.724 . . . . 0.0 112.754 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -64.83 159.91 43.45 Favored 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 122.393 2.062 . . . . 0.0 111.533 174.172 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -75.6 101.95 1.54 Allowed 'Trans proline' 0 C--N 1.351 0.671 0 C-N-CA 124.069 3.179 . . . . 0.0 110.875 -174.425 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 91.8 m -124.32 148.22 47.61 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 125.015 1.326 . . . . 0.0 110.463 -171.771 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 50.6 t80 -145.47 118.88 9.0 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.225 1.81 . . . . 0.0 109.27 175.597 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 71.7 m -140.77 159.97 60.48 Favored Pre-proline 0 N--CA 1.477 0.886 0 C-N-CA 124.306 1.042 . . . . 0.0 113.352 -168.804 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -70.03 156.69 93.39 Favored 'Cis proline' 0 C--N 1.354 0.832 0 CA-C-N 119.723 0.937 . . . . 0.0 111.415 -4.749 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.03 -21.92 64.06 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 176.705 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 51.5 tp -143.68 121.68 12.09 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.311 1.444 . . . . 0.0 108.876 169.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 49.7 tp -111.12 126.96 55.39 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.536 1.534 . . . . 0.0 109.264 173.233 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 40.3 t -115.78 120.08 63.74 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 124.219 1.008 . . . . 0.0 108.927 176.74 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 26.9 m -123.64 166.97 18.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 125.57 1.548 . . . . 0.0 111.72 174.449 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 24.4 m -90.95 151.11 21.21 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.796 1.238 . . . . 0.0 110.701 174.227 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -51.73 124.87 13.42 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.246 1.418 . . . . 0.0 111.56 174.069 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.57 -1.36 88.9 Favored Glycine 0 CA--C 1.533 1.213 0 C-N-CA 125.487 1.517 . . . . 0.0 114.849 -177.856 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -88.67 162.13 16.47 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 119.421 1.61 . . . . 0.0 111.808 175.28 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -89.89 136.44 33.04 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.192 0.997 . . . . 0.0 110.65 176.264 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -116.79 135.95 53.35 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.255 1.422 . . . . 0.0 110.95 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 22.4 m -132.72 124.26 27.83 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 118.945 0.793 . . . . 0.0 111.869 178.729 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -100.79 159.56 15.09 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.648 1.579 . . . . 0.0 110.239 169.009 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 35.9 m -116.22 131.36 56.96 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.154 1.381 . . . . 0.0 110.38 177.51 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 50.3 t -117.96 143.26 46.52 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.457 1.903 . . . . 0.0 112.533 176.42 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 68.7 m -142.82 131.12 22.11 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.602 1.161 . . . . 0.0 111.417 177.158 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 -139.87 156.13 46.86 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 126.641 1.977 . . . . 0.0 113.126 177.588 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.2 t -103.68 134.32 47.22 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.925 1.29 . . . . 0.0 109.438 166.627 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -147.77 177.11 9.58 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.188 1.795 . . . . 0.0 110.802 -177.839 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 87.3 m -59.84 135.71 57.78 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.466 1.107 . . . . 0.0 110.18 173.191 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 44.1 p -72.71 -17.34 61.63 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 114.611 1.337 . . . . 0.0 114.611 -170.387 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -70.49 -46.0 64.59 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.003 0.921 . . . . 0.0 112.104 179.49 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 13.0 t -178.14 159.81 1.32 Allowed 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 126.864 2.066 . . . . 0.0 111.243 175.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 51.0 p90 -162.92 157.75 21.54 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.281 1.832 . . . . 0.0 110.855 179.308 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 46.0 t -107.87 136.07 44.46 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 124.887 1.275 . . . . 0.0 108.715 174.202 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -123.25 123.6 41.13 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.313 1.445 . . . . 0.0 108.776 -177.204 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 9.9 m-80 -123.48 152.51 41.63 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.559 1.543 . . . . 0.0 113.153 -167.474 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 12.6 t90 -117.51 135.71 53.74 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.836 1.654 . . . . 0.0 111.645 175.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -130.69 147.98 52.42 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.239 1.416 . . . . 0.0 113.481 -178.333 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 40.3 ttp180 -100.29 137.26 38.96 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 126.543 1.937 . . . . 0.0 107.331 167.238 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 16.0 ttm -112.02 134.84 53.33 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.321 1.448 . . . . 0.0 110.423 -175.362 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.1 m -91.4 157.5 42.24 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 124.82 1.248 . . . . 0.0 112.143 178.29 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -56.46 -31.48 85.99 Favored 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 124.209 3.273 . . . . 0.0 114.009 176.563 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.4 m -76.93 9.77 2.71 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.209 1.404 . . . . 0.0 113.624 177.852 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 64.2 t30 69.69 26.29 4.97 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 127.104 2.162 . . . . 0.0 112.908 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -94.45 168.36 10.92 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.245 1.018 . . . . 0.0 110.479 172.076 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.0 p -138.81 152.49 47.92 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.069 1.348 . . . . 0.0 111.536 -178.637 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -133.62 129.93 37.6 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 126.584 1.954 . . . . 0.0 110.105 -178.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -82.95 129.05 34.98 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.863 0.865 . . . . 0.0 111.389 -175.325 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 55.3 mt -104.21 -50.02 3.45 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.173 0.989 . . . . 0.0 111.963 -171.121 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -170.25 169.52 7.69 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.611 1.964 . . . . 0.0 109.675 -175.25 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.59 153.27 22.81 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.872 1.269 . . . . 0.0 110.926 -176.074 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -105.48 135.61 19.34 Favored Pre-proline 0 CA--C 1.547 0.846 0 C-N-CA 123.972 0.909 . . . . 0.0 110.994 174.676 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -68.29 148.23 82.51 Favored 'Cis proline' 0 C--N 1.352 0.727 0 CA-C-N 119.395 0.819 . . . . 0.0 111.102 -6.386 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -78.4 94.64 4.92 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.845 0.831 . . . . 0.0 111.857 -172.207 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 53.7 t0 -103.84 97.0 7.07 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.626 1.57 . . . . 0.0 108.314 168.488 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 15.7 mmt85 -76.71 4.16 10.14 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -175.183 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 60.3 p -81.13 -14.29 57.84 Favored 'General case' 0 CA--C 1.547 0.846 0 O-C-N 121.266 -0.896 . . . . 0.0 112.144 167.628 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 60.3 mm-40 -85.2 167.3 26.53 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 125.178 1.391 . . . . 0.0 111.244 175.545 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -61.71 -0.37 1.5 Allowed 'Trans proline' 0 C--N 1.354 0.836 0 C-N-CA 124.529 3.486 . . . . 0.0 116.802 176.382 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -90.12 61.22 3.34 Favored Glycine 0 C--N 1.338 0.645 0 C-N-CA 125.418 1.485 . . . . 0.0 109.441 171.598 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 5.1 tp60 -135.61 114.02 11.61 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.12 0.968 . . . . 0.0 111.313 -175.217 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -142.98 150.18 39.32 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.251 1.821 . . . . 0.0 110.073 168.796 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 75.3 m -70.29 -24.33 63.01 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 114.446 1.276 . . . . 0.0 114.446 -177.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.4 ptp180 -102.66 -21.11 14.18 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 114.71 1.374 . . . . 0.0 114.71 -171.396 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -103.18 147.98 26.34 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.209 1.404 . . . . 0.0 111.968 -172.681 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -143.24 151.98 41.19 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.852 1.661 . . . . 0.0 111.989 172.396 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 46.2 t -121.32 128.56 75.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 124.414 1.085 . . . . 0.0 110.139 169.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 91.5 m -122.96 132.4 54.14 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.137 1.375 . . . . 0.0 110.312 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 24.8 tt0 -86.78 139.08 31.06 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.978 0.911 . . . . 0.0 110.722 173.26 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 28.7 mt -92.46 158.29 38.86 Favored Pre-proline 0 CA--C 1.546 0.794 0 C-N-CA 124.897 1.279 . . . . 0.0 111.808 177.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -67.72 -1.81 7.42 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 123.648 2.899 . . . . 0.0 114.235 175.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 25.3 m120 -64.81 -16.78 63.54 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 172.848 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 105.44 -34.0 6.11 Favored Glycine 0 N--CA 1.474 1.216 0 C-N-CA 126.127 1.822 . . . . 0.0 114.293 170.009 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 35.0 ptt180 -154.58 73.59 0.91 Allowed 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 123.098 1.428 . . . . 0.0 110.813 169.38 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -151.83 137.69 18.05 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 127.761 2.425 . . . . 0.0 106.958 179.32 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 -139.81 139.52 36.39 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -167.626 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -103.55 130.68 51.0 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.836 1.254 . . . . 0.0 111.71 170.51 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -107.04 105.4 15.4 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 127.276 2.23 . . . . 0.0 108.966 179.327 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 30.2 t -107.6 123.92 49.19 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.727 0.811 . . . . 0.0 112.705 -170.23 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 12.1 t -95.25 119.86 43.88 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 126.355 1.862 . . . . 0.0 106.928 169.024 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 81.3 t -91.43 128.54 43.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 123.558 0.743 . . . . 0.0 109.876 175.406 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 69.9 ttt180 53.46 60.55 3.63 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.911 1.684 . . . . 0.0 111.604 174.22 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.06 134.67 52.32 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.735 0.814 . . . . 0.0 111.362 -172.526 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.22 167.28 10.68 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.615 1.566 . . . . 0.0 110.261 -179.439 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 88.4 mtm-85 -56.88 -27.75 60.94 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 120.96 -1.088 . . . . 0.0 113.205 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -56.43 -27.77 57.58 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 126.673 1.989 . . . . 0.0 114.527 169.744 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 -86.95 -14.47 41.7 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 -175.048 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 52.7 m -59.36 129.88 44.19 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.793 1.179 . . . . 0.0 112.066 175.577 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 164.46 -159.7 32.67 Favored Glycine 0 N--CA 1.472 1.09 0 O-C-N 121.792 -0.567 . . . . 0.0 113.727 -176.2 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 8.5 m -100.65 144.42 29.65 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.107 1.363 . . . . 0.0 109.983 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 -143.62 155.43 44.26 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.653 1.581 . . . . 0.0 111.551 -178.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.3 pp -157.12 164.91 37.35 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.891 1.276 . . . . 0.0 112.525 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 21.2 t -113.78 155.51 25.52 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.282 1.433 . . . . 0.0 111.052 -179.382 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -154.67 144.23 10.89 Favored Glycine 0 N--CA 1.471 0.995 0 O-C-N 121.304 -0.873 . . . . 0.0 114.297 177.076 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -132.2 158.2 42.35 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -173.562 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 17.0 tt -152.34 134.97 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 125.316 1.446 . . . . 0.0 111.17 178.37 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 60.9 m -72.9 161.64 30.46 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.108 1.363 . . . . 0.0 113.417 177.324 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -59.73 -21.56 60.85 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 116.122 1.897 . . . . 0.0 116.122 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -72.92 147.73 88.84 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 124.399 1.08 . . . . 0.0 112.653 -173.209 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -67.22 -20.2 49.67 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.085 2.523 . . . . 0.0 112.75 176.469 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 82.7 tttt -75.82 -13.07 60.28 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 124.801 1.241 . . . . 0.0 113.558 174.831 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.11 161.64 26.45 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.533 1.133 . . . . 0.0 113.033 -177.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -147.98 152.76 38.04 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.914 1.686 . . . . 0.0 108.631 175.148 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 36.2 mt -71.69 115.39 11.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 O-C-N 121.695 -0.628 . . . . 0.0 110.63 -176.187 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 48.1 tttp -90.63 141.8 28.41 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.829 1.252 . . . . 0.0 109.661 169.571 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -110.87 151.01 28.35 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.69 1.196 . . . . 0.0 111.96 -175.837 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 59.8 p -86.4 176.95 7.6 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.815 1.246 . . . . 0.0 113.275 174.305 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 99.1 mt -68.65 139.95 55.47 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 166.585 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.63 148.97 33.02 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 -178.33 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -123.76 169.64 11.32 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 127.182 2.193 . . . . 0.0 111.243 177.266 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -119.74 141.7 49.2 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.981 1.312 . . . . 0.0 112.37 179.644 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 52.2 tp -109.69 137.8 46.98 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 125.817 1.647 . . . . 0.0 109.752 169.49 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -128.84 125.01 36.81 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.604 1.562 . . . . 0.0 110.31 173.078 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 40.6 t -108.13 112.44 40.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 C-N-CA 125.224 1.409 . . . . 0.0 108.597 169.314 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 64.6 p -91.59 154.93 18.72 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.573 1.549 . . . . 0.0 110.241 177.698 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -58.88 151.0 22.63 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.754 0.822 . . . . 0.0 112.693 -175.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 22.9 tpt180 -61.0 119.28 7.99 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.895 1.278 . . . . 0.0 109.893 -176.549 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -71.9 141.7 49.52 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 122.953 0.501 . . . . 0.0 111.805 -169.857 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -69.96 154.32 42.1 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.584 1.154 . . . . 0.0 112.906 177.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 . . . . . 0 C--O 1.253 1.241 0 C-N-CA 127.213 2.205 . . . . 0.0 113.394 177.261 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.552 0 CA-C-O 116.277 -1.821 . . . . 0.0 112.389 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -68.93 156.52 65.1 Favored 'Trans proline' 0 CA--C 1.544 0.989 0 C-N-CA 122.461 2.108 . . . . 0.0 110.96 174.578 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -64.58 114.73 2.84 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 124.05 3.166 . . . . 0.0 111.832 -173.285 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.0 t -156.76 154.44 29.98 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.881 1.672 . . . . 0.0 111.568 -178.902 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -134.34 125.66 28.08 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.964 1.706 . . . . 0.0 109.704 -173.073 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 91.0 p -140.87 157.49 67.34 Favored Pre-proline 0 CA--C 1.549 0.909 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 -169.435 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -68.32 162.17 80.04 Favored 'Cis proline' 0 C--N 1.355 0.92 0 CA-C-N 119.474 0.848 . . . . 0.0 111.862 -4.453 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.82 -26.52 68.17 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 176.639 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 48.0 tp -141.81 123.28 14.95 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.493 1.517 . . . . 0.0 108.889 170.319 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 53.7 tp -108.79 125.1 51.58 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.3 1.44 . . . . 0.0 109.34 172.326 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.2 t -110.4 121.39 63.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 124.165 0.986 . . . . 0.0 108.967 175.83 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.5 m -125.46 172.15 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 C-N-CA 125.009 1.323 . . . . 0.0 111.972 173.496 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 9.5 m -96.94 151.86 19.28 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 125.789 1.636 . . . . 0.0 110.612 176.237 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -45.71 122.81 3.9 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.536 1.134 . . . . 0.0 112.525 169.343 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.57 3.21 88.53 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 125.502 1.525 . . . . 0.0 114.508 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 31.2 t0 -90.4 159.12 16.75 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 119.393 1.597 . . . . 0.0 112.375 177.319 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 70.2 m-20 -88.96 117.57 28.07 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.345 1.058 . . . . 0.0 110.369 176.506 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -99.19 130.07 45.47 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.856 1.262 . . . . 0.0 110.547 178.22 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 60.9 m -131.92 127.2 35.93 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 119.347 0.976 . . . . 0.0 111.41 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -101.3 158.44 16.05 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.135 1.774 . . . . 0.0 110.474 172.573 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 37.5 m -106.69 131.23 54.06 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.322 1.449 . . . . 0.0 109.28 173.67 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 48.5 t -111.69 129.74 56.01 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.902 1.281 . . . . 0.0 110.893 169.302 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 8.4 t -122.46 131.22 53.76 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.537 1.135 . . . . 0.0 108.666 173.078 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 41.3 p90 -160.73 156.28 25.12 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.442 1.097 . . . . 0.0 112.291 -176.188 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 31.6 m -131.84 115.19 15.61 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.556 1.142 . . . . 0.0 109.013 169.455 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -84.74 178.01 7.81 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 -173.193 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 23.6 m -58.2 -61.5 2.51 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 126.203 1.801 . . . . 0.0 113.18 -169.541 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 75.3 p -176.63 166.56 2.65 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.961 1.304 . . . . 0.0 112.791 -173.007 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 71.4 -67.07 0.27 Allowed 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 128.429 2.691 . . . . 0.0 113.69 169.68 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 32.9 t 176.3 160.49 0.33 Allowed 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 129.229 3.011 . . . . 0.0 108.222 -170.234 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 28.5 p90 -150.74 162.44 40.71 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 114.718 1.377 . . . . 0.0 114.718 -169.154 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 64.5 t -105.88 129.48 58.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 126.529 1.932 . . . . 0.0 107.017 167.581 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 51.3 tp -99.32 143.21 29.84 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.94 1.296 . . . . 0.0 109.453 173.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -138.62 154.56 48.67 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.507 1.523 . . . . 0.0 111.032 -176.706 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 14.9 t90 -128.74 135.66 49.51 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.019 1.328 . . . . 0.0 110.744 175.254 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 57.8 m-85 -129.06 148.9 51.05 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.95 1.3 . . . . 0.0 113.596 -174.001 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 55.3 ttt-85 -109.03 142.99 38.92 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.694 1.598 . . . . 0.0 108.257 167.466 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 30.1 mtp -85.77 145.88 27.04 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 118.948 0.794 . . . . 0.0 112.509 176.484 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 69.1 m -94.07 157.66 37.42 Favored Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 125.494 1.518 . . . . 0.0 111.37 173.618 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -66.71 -16.72 51.2 Favored 'Trans proline' 0 CA--C 1.54 0.825 0 C-N-CA 123.256 2.637 . . . . 0.0 113.383 176.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 40.7 p -76.98 -1.15 27.26 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.118 1.767 . . . . 0.0 113.783 169.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 70.15 20.98 6.15 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 127.849 2.46 . . . . 0.0 113.08 -172.653 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -88.53 -172.68 3.85 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.423 1.089 . . . . 0.0 110.175 168.672 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.0 p -142.76 151.49 41.29 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.83 1.652 . . . . 0.0 110.728 -176.73 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -128.96 133.41 47.8 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 124.645 1.178 . . . . 0.0 111.616 174.878 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -78.15 129.22 34.9 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.43 1.092 . . . . 0.0 111.472 -179.158 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 57.9 mt -105.57 -47.75 3.84 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 125.575 1.55 . . . . 0.0 112.345 -169.645 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -162.04 170.02 19.99 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 127.072 2.149 . . . . 0.0 109.68 -174.292 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.55 171.52 19.5 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.41 1.084 . . . . 0.0 112.042 -172.291 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -146.79 111.45 4.17 Favored Pre-proline 0 CA--C 1.546 0.799 0 C-N-CA 125.026 1.33 . . . . 0.0 109.462 171.349 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -64.85 155.83 75.8 Favored 'Cis proline' 0 CA--C 1.54 0.794 0 CA-C-N 119.641 0.908 . . . . 0.0 111.721 -5.468 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -76.37 130.73 38.49 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.391 0.677 . . . . 0.0 112.701 -178.687 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 35.0 m-20 -90.94 1.77 56.77 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.108 1.363 . . . . 0.0 112.593 169.647 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 57.4 mtm180 -76.03 14.21 0.74 Allowed 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 127.022 2.129 . . . . 0.0 115.722 -168.595 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 29.4 m -69.73 -24.08 63.49 Favored 'General case' 0 CA--C 1.545 0.755 0 O-C-N 121.215 -0.928 . . . . 0.0 111.796 168.485 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -77.61 152.56 80.83 Favored Pre-proline 0 CA--C 1.548 0.872 0 C-N-CA 125.078 1.351 . . . . 0.0 110.894 169.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -69.93 156.23 63.42 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 123.145 2.563 . . . . 0.0 112.345 -179.278 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 108.42 14.13 17.11 Favored Glycine 0 CA--C 1.535 1.285 0 C-N-CA 125.004 1.287 . . . . 0.0 114.449 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -82.56 170.86 14.72 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.247 1.419 . . . . 0.0 112.412 174.18 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -142.83 139.43 30.9 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.912 1.285 . . . . 0.0 111.414 175.279 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 16.4 m -66.75 -19.0 65.66 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 115.268 1.581 . . . . 0.0 115.268 -169.474 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 82.0 mtt85 -60.77 -44.95 96.1 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -91.34 131.56 36.76 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 -164.554 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 21.4 ttm-85 -144.49 143.99 31.13 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.497 1.119 . . . . 0.0 112.352 169.222 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 91.8 t -107.3 131.31 57.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 126.638 1.975 . . . . 0.0 109.035 173.75 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 90.0 m -130.58 133.27 46.05 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.32 1.448 . . . . 0.0 110.686 -178.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -79.08 141.79 37.04 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.165 0.986 . . . . 0.0 112.318 178.095 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 26.6 mt -92.88 162.4 28.95 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 123.543 0.737 . . . . 0.0 111.628 171.637 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -58.04 -21.03 48.32 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 123.924 3.083 . . . . 0.0 114.093 172.574 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 10.9 t-20 -64.99 -13.83 58.77 Favored 'General case' 0 CA--C 1.552 1.02 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 -179.325 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 83.08 -34.01 2.86 Favored Glycine 0 N--CA 1.475 1.281 0 C-N-CA 125.882 1.706 . . . . 0.0 114.649 171.482 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 23.0 ptt180 -130.17 73.5 1.54 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 125.391 1.476 . . . . 0.0 109.523 169.36 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -178.78 140.68 0.18 Allowed 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 127.569 2.348 . . . . 0.0 109.338 -177.364 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -147.3 153.64 39.97 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.316 1.046 . . . . 0.0 112.79 -168.237 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -106.91 139.51 41.21 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.609 1.564 . . . . 0.0 111.464 169.167 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.4 mpt? -120.1 106.11 11.66 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 126.471 1.908 . . . . 0.0 109.05 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 77.8 p -108.75 128.26 54.72 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.872 0.869 . . . . 0.0 113.333 -172.042 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 32.5 t -100.14 99.07 7.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 127.859 2.463 . . . . 0.0 106.846 169.107 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 29.2 m -74.46 139.77 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 O-C-N 121.749 -0.595 . . . . 0.0 111.861 178.456 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 32.2 ttm180 53.84 49.51 18.96 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.81 1.644 . . . . 0.0 112.626 170.265 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.5 148.56 50.4 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.195 0.998 . . . . 0.0 112.778 -171.007 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -124.32 164.73 19.0 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.836 1.254 . . . . 0.0 111.856 178.83 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 86.5 mtm-85 -52.58 -37.21 57.58 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.401 1.081 . . . . 0.0 113.557 -172.326 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -48.43 -34.31 10.77 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.859 2.064 . . . . 0.0 114.599 171.289 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -81.51 -13.91 57.57 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.504 1.122 . . . . 0.0 112.738 -168.765 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.8 m -59.92 131.1 49.82 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.307 1.043 . . . . 0.0 112.474 179.127 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 161.46 -166.83 36.08 Favored Glycine 0 N--CA 1.473 1.134 0 C-N-CA 124.418 1.008 . . . . 0.0 113.622 -171.749 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 7.6 m -96.62 140.0 31.88 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.28 1.032 . . . . 0.0 110.816 -175.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 64.8 m-85 -136.44 156.73 48.21 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.004 1.722 . . . . 0.0 111.704 179.425 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -156.59 150.89 25.34 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 176.681 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 52.1 t -95.04 151.62 19.03 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 126.486 1.914 . . . . 0.0 111.437 177.648 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -164.1 138.07 5.09 Favored Glycine 0 N--CA 1.472 1.069 0 O-C-N 121.424 -0.797 . . . . 0.0 114.538 172.755 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -121.27 159.2 26.48 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.474 1.11 . . . . 0.0 112.644 -178.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 21.2 tt -147.57 135.9 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 125.586 1.554 . . . . 0.0 111.249 -176.223 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 36.8 t -72.25 161.17 31.23 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.044 0.937 . . . . 0.0 113.46 -178.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 65.7 mt -82.83 -11.45 58.23 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.735 1.214 . . . . 0.0 112.693 169.25 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -68.73 157.23 89.17 Favored Pre-proline 0 CA--C 1.551 1.018 0 C-N-CA 125.067 1.347 . . . . 0.0 112.358 176.193 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -66.97 -21.82 49.18 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 122.968 2.445 . . . . 0.0 113.192 178.2 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.52 6.28 15.3 Favored 'General case' 0 CA--C 1.551 0.994 0 N-CA-C 114.817 1.414 . . . . 0.0 114.817 177.149 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -62.62 159.22 16.44 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.755 1.391 . . . . 0.0 114.755 -171.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -157.23 149.13 22.5 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 127.091 2.156 . . . . 0.0 108.29 -176.478 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 11.7 mm -71.44 107.6 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 171.302 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -82.31 88.42 6.54 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.954 0.902 . . . . 0.0 109.308 173.249 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -69.97 134.68 48.61 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.116 0.966 . . . . 0.0 111.37 -178.237 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 68.7 m -84.74 155.95 21.65 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.155 0.982 . . . . 0.0 112.338 171.457 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -59.82 128.26 36.02 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 121.694 -0.629 . . . . 0.0 109.426 169.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -69.67 157.99 36.21 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 114.371 1.249 . . . . 0.0 114.371 -170.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -127.77 164.41 22.21 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.791 2.037 . . . . 0.0 111.639 176.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -116.24 140.35 49.41 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.767 1.227 . . . . 0.0 111.542 177.354 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 62.1 tp -106.97 134.63 49.83 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.983 1.713 . . . . 0.0 109.563 169.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 59.7 ttt85 -126.92 122.67 35.25 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 125.652 1.581 . . . . 0.0 109.786 170.558 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 36.4 t -107.46 115.99 49.99 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 C-N-CA 124.866 1.266 . . . . 0.0 108.626 171.283 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 23.6 p -87.92 161.72 17.3 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.858 1.263 . . . . 0.0 110.925 -179.506 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -58.13 153.01 15.65 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 122.879 0.471 . . . . 0.0 110.376 168.295 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 17.2 mtt180 -67.22 106.83 2.14 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 123.448 0.699 . . . . 0.0 110.011 176.688 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.77 152.47 39.03 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.267 1.027 . . . . 0.0 111.989 -173.755 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -72.05 154.39 41.16 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.522 1.129 . . . . 0.0 112.586 175.761 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 . . . . . 0 N--CA 1.485 1.285 0 C-N-CA 127.228 2.211 . . . . 0.0 113.383 177.105 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 56.8 mtt . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 116.572 -1.68 . . . . 0.0 112.494 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -69.87 164.2 35.52 Favored 'Trans proline' 0 C--N 1.357 1.02 0 C-N-CA 122.808 2.339 . . . . 0.0 112.2 -179.146 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -59.46 143.71 99.62 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 123.578 2.852 . . . . 0.0 115.667 -174.495 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 15.2 t -143.08 160.15 40.92 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 126.468 1.907 . . . . 0.0 110.197 169.403 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -148.38 121.78 9.06 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.019 1.328 . . . . 0.0 111.075 -169.528 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 89.8 p -140.94 160.23 59.1 Favored Pre-proline 0 CA--C 1.55 0.981 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -172.352 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -68.49 162.55 79.94 Favored 'Cis proline' 0 C--N 1.354 0.825 0 CA-C-N 119.883 0.994 . . . . 0.0 111.482 -7.849 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.6 -30.74 71.57 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 174.325 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 33.1 tp -135.46 123.37 22.63 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.739 1.615 . . . . 0.0 109.061 171.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 57.6 tp -107.49 126.6 52.72 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.587 1.155 . . . . 0.0 109.358 169.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.4 t -110.2 124.32 66.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 124.011 0.924 . . . . 0.0 108.916 173.676 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.6 m -128.24 167.29 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 124.904 1.282 . . . . 0.0 111.938 173.629 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 51.4 m -93.62 148.92 21.66 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.571 1.148 . . . . 0.0 110.466 175.274 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -53.97 119.33 4.89 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.414 1.486 . . . . 0.0 112.103 178.227 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.04 -0.43 78.9 Favored Glycine 0 CA--C 1.532 1.124 0 C-N-CA 126.21 1.862 . . . . 0.0 115.057 -178.068 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 40.6 t0 -86.15 158.73 19.7 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 119.11 1.455 . . . . 0.0 111.223 171.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 12.1 p30 -80.85 150.84 28.96 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-O 121.911 0.862 . . . . 0.0 111.453 169.76 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -133.38 122.59 23.99 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.125 1.77 . . . . 0.0 110.576 -173.443 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 28.0 m -129.38 126.86 39.82 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 118.832 0.742 . . . . 0.0 111.854 -176.57 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -101.95 157.07 17.13 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.212 1.805 . . . . 0.0 109.817 169.466 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 31.6 m -106.35 123.78 48.58 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.944 1.298 . . . . 0.0 109.553 175.509 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 44.8 t -107.08 134.76 49.73 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.657 1.183 . . . . 0.0 109.735 168.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 9.2 m -133.72 128.82 35.72 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.7 0.8 . . . . 0.0 110.222 -174.788 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -158.93 153.56 24.48 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.373 1.069 . . . . 0.0 111.595 173.767 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 63.7 m -83.4 101.57 11.45 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.409 0.623 . . . . 0.0 112.109 -176.24 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 19.7 m120 -69.6 130.54 42.71 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.224 1.009 . . . . 0.0 111.481 178.444 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 70.5 p -104.78 -169.54 1.63 Allowed 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.747 1.619 . . . . 0.0 111.036 -178.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 36.5 p -73.08 -6.54 46.32 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.9 1.28 . . . . 0.0 113.827 170.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -82.45 110.18 17.34 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.702 1.201 . . . . 0.0 109.478 174.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 15.1 m -59.81 138.62 57.74 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.65 1.58 . . . . 0.0 112.285 -178.593 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 32.9 p90 -149.33 168.29 23.75 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 115.154 1.538 . . . . 0.0 115.154 -167.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 58.2 t -124.33 135.29 64.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 127.49 2.316 . . . . 0.0 106.981 167.689 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 29.3 tp -99.39 138.7 36.11 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.509 0.724 . . . . 0.0 109.924 172.514 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.507 HD21 HG22 ' A' ' 126' ' ' ILE . 7.2 m-80 -130.93 159.19 38.17 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.818 1.247 . . . . 0.0 111.483 -172.956 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 9.0 t90 -125.84 138.21 53.8 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.312 1.045 . . . . 0.0 111.979 177.205 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -131.15 144.7 51.57 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.777 1.231 . . . . 0.0 112.796 -176.478 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -106.78 142.61 36.14 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.45 1.5 . . . . 0.0 108.54 168.428 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 26.1 mtp -83.29 143.91 30.07 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.95 0.795 . . . . 0.0 112.461 175.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 69.0 m -105.69 148.55 36.63 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 125.47 1.508 . . . . 0.0 111.081 176.028 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -68.05 -16.04 44.24 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 123.977 3.118 . . . . 0.0 114.024 -173.236 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 17.5 m -76.91 8.61 3.59 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.812 1.245 . . . . 0.0 113.206 171.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 57.6 t30 71.31 46.07 0.45 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 127.805 2.442 . . . . 0.0 111.466 -177.246 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -131.38 -172.66 2.9 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.669 1.588 . . . . 0.0 110.27 -178.528 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.7 p -144.47 149.18 35.56 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.964 1.706 . . . . 0.0 110.526 -176.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -125.28 134.65 52.2 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.106 1.362 . . . . 0.0 111.314 176.229 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -78.84 133.0 37.04 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.988 0.915 . . . . 0.0 111.517 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 53.5 mt -107.65 -46.77 3.75 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.767 1.227 . . . . 0.0 112.714 -169.681 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -169.79 169.42 8.42 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.73 2.012 . . . . 0.0 110.482 -172.359 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -157.25 162.01 39.22 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.861 1.265 . . . . 0.0 113.163 -179.226 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -139.92 122.5 10.12 Favored Pre-proline 0 CA--C 1.547 0.839 0 C-N-CA 126.326 1.851 . . . . 0.0 110.1 174.699 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_exo -53.92 157.27 14.96 Favored 'Cis proline' 0 C--N 1.351 0.661 0 CA-C-N 120.56 1.236 . . . . 0.0 113.719 -7.659 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -62.79 115.08 4.03 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.182 0.993 . . . . 0.0 113.533 -169.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -85.12 7.55 21.29 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 125.521 1.528 . . . . 0.0 111.957 169.172 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.3 tpm_? -53.05 -38.01 62.09 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 127.912 2.485 . . . . 0.0 113.05 178.318 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.5 t 75.01 -54.65 0.66 Allowed 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 127.578 2.351 . . . . 0.0 113.283 175.837 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -135.79 148.7 66.36 Favored Pre-proline 0 CA--C 1.546 0.813 0 C-N-CA 124.873 1.269 . . . . 0.0 112.19 -175.697 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -82.18 174.21 10.2 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 124.436 3.424 . . . . 0.0 111.349 174.105 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 88.8 9.36 68.48 Favored Glycine 0 CA--C 1.531 1.033 0 C-N-CA 124.108 0.861 . . . . 0.0 112.983 -179.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -151.89 138.54 18.76 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.335 1.854 . . . . 0.0 109.25 -178.385 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 15.5 t0 -142.95 137.0 29.1 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.301 1.44 . . . . 0.0 111.007 -179.242 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 84.3 p -94.23 -9.1 37.31 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.801 1.24 . . . . 0.0 113.69 176.842 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 41.3 mtm180 77.77 -27.05 0.17 Allowed 'General case' 0 C--N 1.346 0.436 0 C-N-CA 131.184 3.793 . . . . 0.0 113.845 -176.59 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -67.22 142.11 57.06 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.548 1.539 . . . . 0.0 110.968 168.847 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 85.0 mtm180 -143.85 148.75 35.94 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.997 1.719 . . . . 0.0 111.281 -174.825 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.435 HG22 ' SD ' ' A' ' 108' ' ' MET . 40.2 t -126.49 126.33 68.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 125.451 1.5 . . . . 0.0 108.452 171.591 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 87.9 m -130.61 130.52 44.1 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.075 0.95 . . . . 0.0 110.996 178.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 65.4 tt0 -82.85 135.08 35.05 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 118.658 0.663 . . . . 0.0 110.042 169.501 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 37.1 mt -91.85 158.94 39.13 Favored Pre-proline 0 CA--C 1.543 0.681 0 C-N-CA 124.112 0.965 . . . . 0.0 112.205 -172.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -63.92 -6.88 11.9 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 123.64 2.893 . . . . 0.0 114.02 174.574 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -63.32 -26.15 68.63 Favored 'General case' 0 CA--C 1.55 0.974 0 CA-C-N 119.462 1.028 . . . . 0.0 112.155 168.872 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 91.19 -34.08 4.44 Favored Glycine 0 CA--C 1.531 1.037 0 C-N-CA 126.717 2.103 . . . . 0.0 113.938 175.155 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -126.84 73.44 1.41 Allowed 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.917 1.287 . . . . 0.0 109.48 171.376 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -178.37 146.0 0.36 Allowed 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 126.396 1.878 . . . . 0.0 110.742 -177.416 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -145.83 139.8 26.62 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.031 0.933 . . . . 0.0 111.773 -170.476 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -98.91 131.03 45.3 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.403 1.081 . . . . 0.0 111.85 169.842 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.435 ' SD ' HG22 ' A' ' 97' ' ' VAL . 20.8 mmt -108.98 103.24 12.23 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.983 2.113 . . . . 0.0 107.726 174.516 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 22.8 t -121.46 125.55 47.16 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 114.9 1.444 . . . . 0.0 114.9 -167.579 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 3.7 t -92.35 123.24 44.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 125.244 1.417 . . . . 0.0 108.229 168.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 87.6 t -82.89 128.4 38.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 168.674 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 44.3 ttt85 56.78 69.67 0.72 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.787 1.235 . . . . 0.0 112.07 171.03 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -74.35 134.48 42.5 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.409 1.083 . . . . 0.0 111.508 -177.324 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -108.63 163.03 13.6 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.032 1.733 . . . . 0.0 109.666 174.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 64.6 mtp85 -56.83 -28.01 60.94 Favored 'General case' 0 N--CA 1.478 0.947 0 O-C-N 121.021 -1.049 . . . . 0.0 113.74 179.116 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -61.46 -16.72 49.79 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.306 1.443 . . . . 0.0 114.623 171.441 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -89.68 -12.84 38.35 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.218 1.407 . . . . 0.0 113.634 178.88 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 48.1 m -64.74 138.16 58.22 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 120.815 -1.178 . . . . 0.0 112.132 -178.176 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 149.2 -165.8 29.43 Favored Glycine 0 N--CA 1.474 1.192 0 C-N-CA 124.13 0.871 . . . . 0.0 113.592 -176.718 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.5 m -91.23 142.66 27.48 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.165 1.386 . . . . 0.0 111.284 -174.903 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -138.78 160.82 38.76 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.678 1.991 . . . . 0.0 111.745 -178.265 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -156.29 147.12 21.96 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.603 1.161 . . . . 0.0 113.355 173.517 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 51.4 t -84.16 150.44 25.51 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.341 1.857 . . . . 0.0 110.704 173.156 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -161.43 129.52 2.13 Favored Glycine 0 N--CA 1.474 1.172 0 O-C-N 121.184 -0.947 . . . . 0.0 114.4 174.209 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -90.66 159.26 16.49 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.151 0.981 . . . . 0.0 112.197 178.638 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.507 HG22 HD21 ' A' ' 66' ' ' ASN . 17.2 tt -146.39 138.67 19.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 124.702 1.201 . . . . 0.0 109.781 170.515 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 7.3 m -81.11 161.48 24.1 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.763 0.825 . . . . 0.0 112.384 179.609 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 55.9 mt -78.6 -12.51 60.02 Favored 'General case' 0 N--CA 1.476 0.875 0 N-CA-C 114.115 1.154 . . . . 0.0 114.115 178.101 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -67.03 148.19 98.93 Favored Pre-proline 0 CA--C 1.553 1.064 0 C-N-CA 124.12 0.968 . . . . 0.0 112.532 179.072 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -55.96 -28.79 70.46 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 123.598 2.865 . . . . 0.0 114.601 176.135 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -85.14 4.42 34.45 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.747 1.219 . . . . 0.0 114.227 -179.063 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -63.09 159.17 17.88 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.99 1.108 . . . . 0.0 113.99 -176.727 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -150.63 166.54 30.02 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.73 2.012 . . . . 0.0 109.005 174.268 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 51.0 mt -73.11 114.16 12.05 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-O 121.584 0.707 . . . . 0.0 109.918 -178.155 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -81.47 88.37 6.16 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.991 1.716 . . . . 0.0 107.917 169.703 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -75.4 141.73 43.18 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.136 0.975 . . . . 0.0 112.354 -171.11 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 6.9 t -91.35 178.64 5.91 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.803 1.241 . . . . 0.0 111.848 169.198 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.6 pp -76.35 159.05 30.88 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.868 0.867 . . . . 0.0 112.061 174.292 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 91.0 mtm180 -83.58 150.54 25.87 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.251 1.02 . . . . 0.0 113.038 -174.753 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -136.93 169.62 17.47 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 127.164 2.186 . . . . 0.0 109.693 169.82 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -132.57 147.57 52.35 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 177.45 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 63.6 tp -107.41 134.46 50.42 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 126.982 2.113 . . . . 0.0 109.954 177.867 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 69.5 ttt180 -122.62 121.55 36.7 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 125.938 1.695 . . . . 0.0 109.885 171.393 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 44.2 t -103.39 117.6 49.09 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.704 1.202 . . . . 0.0 108.848 170.692 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 74.4 p -96.54 150.97 20.03 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.578 1.551 . . . . 0.0 110.24 177.849 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -64.03 142.74 58.3 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.328 0.585 . . . . 0.0 111.851 -178.619 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 54.1 ttp180 -78.14 116.81 18.87 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.782 0.833 . . . . 0.0 110.147 179.291 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 6.5 ppt_? -72.86 163.6 27.89 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.17 0.988 . . . . 0.0 112.771 -178.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -68.03 150.4 48.49 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.35 1.06 . . . . 0.0 112.592 177.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 . . . . . 0 C--O 1.253 1.259 0 N-CA-C 114.925 1.454 . . . . 0.0 114.925 -177.205 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 33' ' ' MET . . . . . 0.463 ' N ' ' HG ' ' A' ' 57' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.487 0 CA-C-O 118.611 -0.709 . . . . 0.0 111.586 . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -57.35 153.38 40.86 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 123.888 3.059 . . . . 0.0 113.337 178.225 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -73.24 118.02 5.35 Favored 'Trans proline' 0 N--CA 1.459 -0.538 0 C-N-CA 123.759 2.973 . . . . 0.0 110.531 176.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 66.6 p -129.0 157.47 41.61 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.264 1.026 . . . . 0.0 112.043 -176.702 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -144.14 124.66 13.98 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.043 1.737 . . . . 0.0 108.869 178.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 78.9 p -140.82 161.15 55.67 Favored Pre-proline 0 CA--C 1.55 0.95 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 -168.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -66.43 163.54 69.51 Favored 'Cis proline' 0 C--N 1.355 0.881 0 CA-C-N 119.572 0.883 . . . . 0.0 111.664 -7.509 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.78 -33.12 71.28 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 174.481 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.6 tt -136.34 124.32 22.82 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.61 1.564 . . . . 0.0 109.139 171.02 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.4 tp -106.75 130.3 54.49 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.75 1.22 . . . . 0.0 108.948 169.842 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 12.8 p -113.0 129.92 67.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 C-N-CA 124.007 0.923 . . . . 0.0 109.692 169.348 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.6 m -131.81 164.76 33.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 125.065 1.346 . . . . 0.0 111.348 174.022 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 16.8 m -89.87 149.02 22.83 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.553 1.141 . . . . 0.0 110.303 172.422 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -53.88 121.7 8.5 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.047 1.339 . . . . 0.0 111.015 175.657 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.24 4.12 78.01 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 125.486 1.517 . . . . 0.0 114.894 -176.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -95.71 150.21 20.63 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 119.577 1.688 . . . . 0.0 111.159 169.783 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -75.41 130.77 39.5 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.267 -0.896 . . . . 0.0 111.543 175.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -101.71 122.08 43.25 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 125.47 1.508 . . . . 0.0 110.174 175.419 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 60.5 m -128.16 124.35 36.62 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.023 0.929 . . . . 0.0 110.827 -178.422 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -102.45 159.54 15.34 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 127.21 2.204 . . . . 0.0 110.524 175.265 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 30.7 m -113.21 127.55 56.21 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.956 1.302 . . . . 0.0 110.006 177.793 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 53.1 t -111.66 142.02 44.51 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.785 1.634 . . . . 0.0 111.854 173.33 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.5 t -138.89 119.32 13.8 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.717 0.807 . . . . 0.0 111.309 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -132.06 156.16 46.79 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 126.235 1.814 . . . . 0.0 113.103 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.463 ' HG ' ' N ' ' A' ' 33' ' ' MET . 86.1 p -138.78 158.04 44.95 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.449 1.9 . . . . 0.0 107.701 166.139 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -147.06 152.02 37.86 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 121.188 -0.945 . . . . 0.0 113.474 -168.481 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 21.0 p -80.18 -26.66 39.15 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.73 1.612 . . . . 0.0 112.902 178.64 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 49.5 m -84.27 152.61 24.06 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.487 1.115 . . . . 0.0 111.1 170.269 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -70.17 -11.34 60.83 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.316 1.846 . . . . 0.0 114.653 -176.852 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 25.8 m -161.37 152.54 18.58 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 126.251 1.821 . . . . 0.0 110.993 176.406 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 55.2 p90 -160.73 159.22 29.88 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.847 1.259 . . . . 0.0 112.396 -173.063 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 90.7 t -95.97 134.77 32.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 125.672 1.589 . . . . 0.0 107.467 169.576 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.4 tp -99.33 145.84 26.9 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.705 1.202 . . . . 0.0 109.472 170.659 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -134.92 156.76 48.41 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.844 1.657 . . . . 0.0 111.984 -169.582 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 22.6 t90 -136.24 138.84 42.24 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.553 1.141 . . . . 0.0 112.103 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 48.6 m-85 -138.9 149.09 44.43 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.818 1.247 . . . . 0.0 114.009 -172.558 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -109.13 143.36 38.61 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.779 1.631 . . . . 0.0 108.531 167.566 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 31.7 mtp -84.58 143.92 28.98 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 119.437 1.017 . . . . 0.0 112.612 173.492 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 45.6 m -91.48 158.02 41.31 Favored Pre-proline 0 CA--C 1.548 0.901 0 C-N-CA 124.954 1.302 . . . . 0.0 111.601 173.476 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_exo -55.5 -32.39 82.3 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 123.983 3.122 . . . . 0.0 114.495 178.373 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.0 m -76.94 5.93 7.11 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 124.892 1.277 . . . . 0.0 113.845 177.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 73.99 20.94 2.71 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 127.828 2.451 . . . . 0.0 113.041 -176.852 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -89.4 -172.61 3.68 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.585 1.154 . . . . 0.0 110.287 169.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.1 p -144.06 146.96 33.18 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 125.597 1.559 . . . . 0.0 110.521 -176.351 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -121.96 132.42 54.53 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 125.077 1.351 . . . . 0.0 110.848 175.317 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 33.3 tttm -80.57 117.18 21.05 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.194 1.398 . . . . 0.0 110.9 -177.346 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 71.7 mt -90.07 -52.72 4.81 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 125.187 1.395 . . . . 0.0 111.253 -172.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -160.74 173.51 15.3 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.84 1.256 . . . . 0.0 111.79 -178.242 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -156.06 156.4 34.31 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.437 1.495 . . . . 0.0 111.798 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -142.0 129.46 11.5 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 125.004 1.322 . . . . 0.0 110.73 178.45 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.17 155.84 19.97 Favored 'Cis proline' 0 C--N 1.353 0.766 0 CA-C-N 120.498 1.214 . . . . 0.0 112.825 -8.315 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -58.9 115.26 3.0 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 114.006 1.113 . . . . 0.0 114.006 -168.754 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -85.93 -0.26 54.97 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.315 1.446 . . . . 0.0 111.777 168.188 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 45.6 ttt85 -66.09 -77.68 0.06 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 127.936 2.494 . . . . 0.0 111.233 -179.081 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 10.9 t 67.44 -59.72 0.4 Allowed 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 127.207 2.203 . . . . 0.0 112.009 -172.079 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -117.99 155.53 51.09 Favored Pre-proline 0 CA--C 1.547 0.84 0 C-N-CA 127.071 2.148 . . . . 0.0 108.166 168.546 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -57.76 116.13 3.01 Favored 'Trans proline' 0 C--N 1.351 0.69 0 C-N-CA 122.874 2.383 . . . . 0.0 113.996 -171.119 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -106.32 -3.55 38.2 Favored Glycine 0 CA--C 1.535 1.293 0 C-N-CA 125.372 1.463 . . . . 0.0 113.037 171.021 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -159.62 159.19 32.85 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 128.106 2.562 . . . . 0.0 109.752 -174.758 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -73.59 159.78 32.61 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.818 0.847 . . . . 0.0 112.032 175.455 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 83.6 p -67.34 -5.8 15.97 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 114.393 1.257 . . . . 0.0 114.393 -177.472 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 48.1 mtp180 -68.78 -30.53 69.14 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.333 1.453 . . . . 0.0 113.002 173.283 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -97.7 119.71 36.77 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.221 1.409 . . . . 0.0 110.398 -174.07 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -139.48 145.67 39.06 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.416 1.086 . . . . 0.0 112.044 -169.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -126.56 135.95 62.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 125.153 1.381 . . . . 0.0 112.052 170.616 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 91.8 m -130.5 130.17 43.84 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.446 1.498 . . . . 0.0 110.756 -177.081 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -79.37 134.32 36.58 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.318 1.047 . . . . 0.0 110.371 173.429 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 36.4 mt -88.27 159.65 47.18 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 123.657 0.783 . . . . 0.0 111.829 178.199 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -63.4 -7.46 12.38 Favored 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 123.563 2.842 . . . . 0.0 113.979 173.528 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -67.23 -14.5 62.97 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 119.174 0.897 . . . . 0.0 112.946 169.157 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 83.98 -34.08 3.04 Favored Glycine 0 N--CA 1.473 1.123 0 C-N-CA 126.92 2.2 . . . . 0.0 114.343 172.092 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.67 73.59 1.46 Allowed 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 123.733 1.73 . . . . 0.0 109.669 173.349 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -174.89 141.72 0.62 Allowed 'General case' 0 C--O 1.237 0.418 0 C-N-CA 128.51 2.724 . . . . 0.0 108.095 -176.413 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -145.04 149.92 35.96 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.853 1.057 . . . . 0.0 113.853 -167.729 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -104.06 132.77 49.97 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.805 1.242 . . . . 0.0 110.479 167.813 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -112.87 123.31 50.02 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 126.652 1.981 . . . . 0.0 108.211 174.502 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 9.4 t -130.44 133.75 46.58 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 114.257 1.206 . . . . 0.0 114.257 -169.848 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 61.7 t -105.35 101.92 13.07 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 126.651 1.98 . . . . 0.0 106.817 168.7 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 98.0 t -73.2 125.53 32.3 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 123.66 0.784 . . . . 0.0 110.649 -177.629 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 72.3 mtt-85 51.08 70.42 0.53 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.597 1.959 . . . . 0.0 112.034 -177.617 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -66.34 134.09 51.86 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.79 1.636 . . . . 0.0 111.476 -178.249 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 8.3 mpt_? -108.38 166.68 10.58 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 126.11 1.764 . . . . 0.0 109.289 172.597 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 35.2 mtp180 -57.22 -30.2 64.39 Favored 'General case' 0 N--CA 1.478 0.962 0 O-C-N 121.033 -1.042 . . . . 0.0 113.619 -174.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -61.68 -19.39 62.29 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.464 1.506 . . . . 0.0 114.756 173.222 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 37.4 m-20 -84.59 -12.83 53.28 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 119.966 1.257 . . . . 0.0 113.481 177.223 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 48.4 m -63.1 143.85 57.42 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.734 1.152 . . . . 0.0 112.597 -179.466 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 143.42 -166.83 26.72 Favored Glycine 0 N--CA 1.474 1.173 0 O-C-N 121.262 -0.898 . . . . 0.0 113.469 -176.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.9 m -91.71 143.59 26.39 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 125.173 1.389 . . . . 0.0 111.08 -172.852 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -142.19 161.2 38.6 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.09 1.756 . . . . 0.0 111.57 -177.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -161.68 165.12 28.66 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.926 1.29 . . . . 0.0 113.054 177.351 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 13.6 t -108.79 156.65 19.38 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.974 1.709 . . . . 0.0 111.038 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -144.66 174.6 24.76 Favored Glycine 0 N--CA 1.47 0.959 0 C-N-CA 124.791 1.186 . . . . 0.0 113.436 176.274 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -152.45 159.24 43.39 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.184 0.994 . . . . 0.0 112.934 175.114 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 18.1 tt -152.22 135.01 6.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 125.463 1.505 . . . . 0.0 110.286 174.511 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 58.1 p -72.48 161.51 30.7 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.249 -0.907 . . . . 0.0 113.146 178.023 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 48.2 mt -75.58 -2.15 27.81 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 -179.029 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -68.07 150.83 97.6 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 124.611 1.164 . . . . 0.0 112.521 177.683 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_endo -69.51 -23.59 31.75 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.016 2.477 . . . . 0.0 112.787 176.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -91.38 8.1 37.83 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 125.088 1.355 . . . . 0.0 113.717 178.594 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.14 161.71 18.52 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.743 1.217 . . . . 0.0 113.922 -175.124 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -149.48 151.83 34.6 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.783 1.633 . . . . 0.0 109.251 178.233 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 51.2 mt -76.1 127.78 37.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 123.594 0.758 . . . . 0.0 111.957 -173.174 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -99.35 151.03 21.53 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.126 1.77 . . . . 0.0 109.328 168.097 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -132.54 149.12 52.37 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.27 1.028 . . . . 0.0 111.969 -172.427 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 60.6 p -87.6 177.85 6.94 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.858 1.263 . . . . 0.0 113.725 175.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -68.38 152.25 45.7 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.636 0.774 . . . . 0.0 109.208 166.75 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -82.12 152.84 26.36 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.113 0.965 . . . . 0.0 113.332 -177.405 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -124.67 169.66 11.75 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 127.158 2.183 . . . . 0.0 109.932 169.038 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -135.97 151.51 50.01 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 170.413 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 60.4 tp -112.87 132.91 55.1 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 126.704 2.002 . . . . 0.0 110.543 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 69.9 ttt180 -118.06 118.06 30.89 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.477 1.911 . . . . 0.0 109.663 171.437 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 42.4 t -102.3 116.67 46.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 123.82 0.848 . . . . 0.0 109.012 169.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 73.7 p -95.96 154.2 17.36 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.967 1.707 . . . . 0.0 110.606 178.251 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -64.61 145.61 55.91 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.641 -0.662 . . . . 0.0 112.32 -178.06 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 38.9 ttt85 -82.71 128.63 34.54 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.476 1.111 . . . . 0.0 110.361 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 36.2 ttp180 -72.16 147.87 46.18 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.532 0.733 . . . . 0.0 111.792 -177.395 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -67.85 154.35 41.75 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 123.99 0.916 . . . . 0.0 111.091 167.844 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 . . . . . 0 N--CA 1.485 1.296 0 C-N-CA 127.531 2.332 . . . . 0.0 113.242 179.35 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 97.3 mmm . . . . . 0 N--CA 1.49 1.534 0 CA-C-O 118.927 -0.559 . . . . 0.0 110.663 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -69.92 140.43 42.03 Favored 'Trans proline' 0 CA--C 1.543 0.944 0 C-N-CA 122.54 2.16 . . . . 0.0 110.917 178.831 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -73.26 155.94 51.21 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 123.44 2.76 . . . . 0.0 111.138 174.583 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.8 t -170.16 150.69 3.74 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.771 1.228 . . . . 0.0 111.758 -178.048 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.55 ' CE1' ' HB3' ' A' ' 123' ' ' CYS . 1.0 OUTLIER -125.99 136.52 53.08 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 125.522 1.529 . . . . 0.0 109.674 178.164 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 88.9 p -141.02 156.2 68.44 Favored Pre-proline 0 N--CA 1.478 0.935 0 N-CA-C 114.793 1.405 . . . . 0.0 114.793 -178.732 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -69.52 161.55 85.24 Favored 'Cis proline' 0 C--N 1.352 0.747 0 CA-C-N 119.307 0.788 . . . . 0.0 111.194 -10.411 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.47 -34.09 73.52 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 172.418 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 31.9 tp -132.83 121.14 22.51 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.757 1.623 . . . . 0.0 109.04 171.713 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 51.5 tp -105.09 130.38 53.29 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.63 1.172 . . . . 0.0 109.475 170.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.1 t -112.92 124.97 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 123.864 0.865 . . . . 0.0 109.104 173.087 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.3 m -127.22 166.36 24.1 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 C-N-CA 125.03 1.332 . . . . 0.0 111.828 173.417 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 45.4 m -91.47 147.16 23.22 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.337 1.055 . . . . 0.0 110.211 173.384 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 65.1 tt0 -53.96 116.44 2.56 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.79 1.636 . . . . 0.0 112.245 177.57 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 94.23 3.61 63.28 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 126.365 1.936 . . . . 0.0 114.825 -177.25 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 37.2 t0 -91.2 159.51 16.02 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 119.581 1.69 . . . . 0.0 111.622 172.507 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -85.32 130.58 34.56 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.224 -0.923 . . . . 0.0 111.373 172.263 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -103.01 133.83 47.47 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.923 1.689 . . . . 0.0 110.745 178.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 27.8 m -132.74 127.98 35.88 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.446 1.099 . . . . 0.0 111.906 178.879 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -105.36 159.56 15.81 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.222 2.209 . . . . 0.0 110.465 169.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 29.7 m -101.13 140.58 35.23 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.606 1.563 . . . . 0.0 109.182 169.56 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 17.4 t -131.53 131.94 43.78 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.697 1.599 . . . . 0.0 111.594 171.586 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 9.9 m -122.97 132.71 54.27 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.38 1.072 . . . . 0.0 111.109 179.271 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -137.76 156.13 48.3 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 126.168 1.787 . . . . 0.0 113.157 169.455 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 92.7 p -151.11 152.81 33.91 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.684 1.593 . . . . 0.0 109.231 167.345 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 69.8 m-80 -149.06 161.88 41.07 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.738 1.215 . . . . 0.0 112.1 -169.828 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 17.2 p -66.78 -43.24 84.49 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.375 1.47 . . . . 0.0 111.12 172.571 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 67.7 m -68.81 128.15 35.65 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.957 1.303 . . . . 0.0 110.059 169.036 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -72.13 -4.64 30.26 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.02 1.328 . . . . 0.0 114.281 -172.785 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 63.4 p -149.41 147.02 27.77 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.168 1.387 . . . . 0.0 112.072 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 38.1 p90 -166.01 159.67 15.81 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.354 1.462 . . . . 0.0 111.809 -171.002 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 30.4 t -95.97 138.27 21.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 125.387 1.475 . . . . 0.0 107.594 170.699 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 9.0 tt -127.78 131.26 49.64 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.373 1.469 . . . . 0.0 109.583 -177.334 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -145.66 160.91 41.0 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 115.323 1.601 . . . . 0.0 115.323 -167.581 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 61.1 t-105 -113.94 148.84 36.16 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 126.585 1.954 . . . . 0.0 112.253 -179.723 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -141.14 146.63 37.27 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.528 1.531 . . . . 0.0 113.89 -172.239 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 34.3 ttp-105 -91.21 140.21 30.01 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.887 1.675 . . . . 0.0 108.152 167.646 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 21.1 mtp -86.6 136.75 32.93 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 119.328 0.967 . . . . 0.0 111.021 168.274 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 68.8 m -106.32 148.67 37.11 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 125.143 1.377 . . . . 0.0 110.986 177.187 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -68.45 -17.6 43.81 Favored 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 124.085 3.19 . . . . 0.0 113.711 -171.065 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.4 m -76.97 21.31 0.22 Allowed 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 125.278 1.431 . . . . 0.0 112.927 170.765 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 64.5 t30 64.35 39.99 6.79 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.685 2.394 . . . . 0.0 112.455 177.447 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -133.05 179.24 6.3 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.139 1.376 . . . . 0.0 111.001 -172.573 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.8 p -137.03 152.51 50.19 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 125.528 1.531 . . . . 0.0 111.043 -177.341 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -133.33 131.56 40.27 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.747 1.219 . . . . 0.0 110.88 178.373 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 5.4 ttpm? -78.91 132.43 36.75 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.553 0.741 . . . . 0.0 111.876 -173.355 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 83.9 mt -110.49 -46.82 3.35 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 125.038 1.335 . . . . 0.0 112.205 -171.524 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -152.84 160.02 43.07 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.39 1.076 . . . . 0.0 111.573 -179.655 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -154.07 149.05 26.74 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.513 1.125 . . . . 0.0 112.977 -172.368 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -136.02 126.8 16.79 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 125.916 1.686 . . . . 0.0 109.908 169.456 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -54.69 162.88 12.17 Favored 'Cis proline' 0 C--N 1.351 0.709 0 CA-C-N 120.275 1.134 . . . . 0.0 113.278 -10.733 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -63.96 113.93 3.79 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.754 0.821 . . . . 0.0 112.335 -170.075 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -161.17 41.43 0.15 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.391 1.877 . . . . 0.0 110.589 -173.836 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -65.07 -38.19 89.99 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 114.165 1.172 . . . . 0.0 114.165 -169.19 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 7.9 m 78.75 -3.89 2.19 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 127.648 2.379 . . . . 0.0 114.271 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.5 pp0? -76.56 162.76 69.56 Favored Pre-proline 0 CA--C 1.551 1.009 0 C-N-CA 124.636 1.174 . . . . 0.0 111.56 173.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -62.1 -4.29 4.88 Favored 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 124.424 3.416 . . . . 0.0 118.544 -170.03 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 89.9 0.69 77.71 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 125.793 1.663 . . . . 0.0 111.649 -170.014 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 19.9 mm100 -88.46 -28.92 20.54 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.464 1.106 . . . . 0.0 113.619 -174.89 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -82.92 129.22 34.99 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -179.348 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 8.0 t -118.1 7.83 12.28 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 124.845 1.258 . . . . 0.0 112.716 171.174 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 47.8 mtp180 -84.07 -42.0 16.58 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.421 1.089 . . . . 0.0 112.658 -171.61 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -95.98 133.63 39.97 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.222 1.009 . . . . 0.0 111.083 -176.368 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 66.2 mtm180 -143.33 152.24 41.41 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.174 0.99 . . . . 0.0 113.105 -171.359 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.8 t -121.61 130.61 74.45 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 126.483 1.913 . . . . 0.0 108.562 169.597 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 94.6 m -129.44 135.41 48.63 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 125.17 1.388 . . . . 0.0 110.444 -175.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -76.31 141.75 41.5 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.217 1.007 . . . . 0.0 111.519 178.78 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 96.4 mt -101.48 157.05 34.4 Favored Pre-proline 0 CA--C 1.542 0.661 0 C-N-CA 124.16 0.984 . . . . 0.0 111.582 170.35 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -70.39 -2.8 11.21 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 123.537 2.825 . . . . 0.0 113.527 173.573 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -72.46 -6.0 40.63 Favored 'General case' 0 CA--C 1.551 1.019 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -179.581 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 95.55 -31.92 6.72 Favored Glycine 0 CA--C 1.534 1.266 0 C-N-CA 126.019 1.771 . . . . 0.0 115.27 169.47 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 32.6 ptt180 -154.6 73.76 0.91 Allowed 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.546 1.538 . . . . 0.0 109.905 172.882 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -167.36 145.47 4.77 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 126.287 1.835 . . . . 0.0 108.925 -169.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -144.42 150.11 37.15 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -168.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -101.1 138.0 38.71 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.239 1.416 . . . . 0.0 110.111 167.474 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 6.9 mmt -123.51 117.84 26.02 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 126.545 1.938 . . . . 0.0 108.3 -176.002 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 71.0 p -131.27 148.7 52.72 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 115.602 1.704 . . . . 0.0 115.602 -169.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 22.1 t -118.66 102.76 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 C-N-CA 127.478 2.311 . . . . 0.0 107.233 176.55 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 58.6 t -78.02 131.86 33.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 124.006 0.923 . . . . 0.0 110.147 -178.015 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 3.7 tpt180 63.07 53.93 2.22 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.423 1.489 . . . . 0.0 111.198 175.738 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.43 123.61 22.75 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.573 1.149 . . . . 0.0 111.062 -174.392 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? -106.73 169.76 8.34 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 126.085 1.754 . . . . 0.0 110.295 177.61 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 22.2 mmm180 -49.19 -37.35 22.33 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.61 1.164 . . . . 0.0 113.84 -175.793 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -60.07 -25.09 65.1 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 125.271 1.429 . . . . 0.0 114.697 175.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 -81.8 -1.87 48.88 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.896 1.278 . . . . 0.0 113.272 178.44 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 33.1 m -70.32 124.04 23.18 Favored 'General case' 0 CA--C 1.543 0.699 0 O-C-N 120.18 -1.575 . . . . 0.0 111.238 173.749 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 165.96 -171.48 41.08 Favored Glycine 0 N--CA 1.474 1.173 0 O-C-N 121.682 -0.636 . . . . 0.0 114.306 -177.068 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.0 m -88.9 139.72 30.17 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.725 1.21 . . . . 0.0 110.714 -179.254 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -144.2 157.67 44.16 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.046 1.738 . . . . 0.0 111.007 -177.376 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.5 pp -155.16 165.36 36.93 Favored 'General case' 0 N--CA 1.469 0.478 0 O-C-N 121.25 -0.906 . . . . 0.0 113.243 -178.648 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' CYS . . . . . 0.55 ' HB3' ' CE1' ' A' ' 37' ' ' PHE . 48.4 t -111.16 156.12 21.88 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.243 1.417 . . . . 0.0 110.574 175.064 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -144.51 167.95 26.89 Favored Glycine 0 CA--C 1.524 0.653 0 C-N-CA 124.496 1.046 . . . . 0.0 112.536 171.643 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -145.13 149.34 34.83 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.869 0.868 . . . . 0.0 111.844 175.334 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.4 tt -148.9 133.08 8.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 125.452 1.501 . . . . 0.0 110.842 -176.091 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 14.5 m -66.39 159.58 26.61 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.397 1.079 . . . . 0.0 112.656 179.604 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 29.4 mt -73.28 -14.38 61.3 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.213 1.19 . . . . 0.0 114.213 -174.735 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -72.35 143.03 85.09 Favored Pre-proline 0 CA--C 1.552 1.054 0 C-N-CA 124.294 1.037 . . . . 0.0 112.329 177.65 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -56.22 -27.01 64.07 Favored 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 123.829 3.019 . . . . 0.0 115.153 177.782 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -78.81 -4.34 48.96 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 -178.575 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.97 169.49 13.18 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 124.891 1.276 . . . . 0.0 113.766 -176.894 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -149.76 162.48 40.18 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.157 1.783 . . . . 0.0 110.21 175.739 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 10.0 mm -73.08 123.44 27.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-O 121.756 0.789 . . . . 0.0 111.757 -178.217 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -84.67 143.29 29.31 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 126.799 2.04 . . . . 0.0 110.171 169.636 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -134.14 158.85 42.6 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.594 1.558 . . . . 0.0 112.188 -172.12 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 5.9 t -140.21 -163.88 1.6 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.784 1.234 . . . . 0.0 111.664 169.733 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -65.89 114.34 5.04 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.545 1.538 . . . . 0.0 110.424 -178.695 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 1.4 ptp180 -71.43 154.74 41.31 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 125.372 1.469 . . . . 0.0 112.939 -177.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.89 169.63 9.09 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.633 1.973 . . . . 0.0 111.225 -171.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -136.51 146.84 46.69 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 122.228 1.013 . . . . 0.0 112.956 175.87 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 58.4 tp -109.69 134.29 52.14 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 127.1 2.16 . . . . 0.0 109.531 179.41 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 70.6 ttt180 -121.12 123.91 43.46 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 125.937 1.695 . . . . 0.0 109.574 171.775 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 53.9 t -103.07 120.44 52.93 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 C-N-CA 124.497 1.119 . . . . 0.0 108.132 169.453 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 54.7 p -93.29 147.53 22.83 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.289 1.436 . . . . 0.0 109.411 174.099 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -59.86 148.07 36.1 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.444 0.698 . . . . 0.0 112.244 -174.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 60.1 ttp180 -58.27 114.37 2.38 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 125.016 1.326 . . . . 0.0 110.199 -170.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 46.6 mtm105 -75.3 153.82 37.71 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.685 -168.793 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -70.54 154.38 41.94 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.545 1.138 . . . . 0.0 112.424 175.112 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 . . . . . 0 C--O 1.254 1.314 0 C-N-CA 125.27 1.428 . . . . 0.0 112.992 177.16 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 56.6 ttm . . . . . 0 N--CA 1.489 1.518 0 CA-C-O 118.191 -0.909 . . . . 0.0 110.343 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -60.0 166.74 8.27 Favored 'Trans proline' 0 CA--C 1.544 1.006 0 C-N-CA 123.98 3.12 . . . . 0.0 113.199 172.511 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -56.8 148.75 64.33 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 123.463 2.775 . . . . 0.0 113.313 174.593 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.2 t -171.76 147.72 2.29 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.496 1.518 . . . . 0.0 111.395 -178.563 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -122.52 135.36 54.63 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.166 1.386 . . . . 0.0 110.776 -172.622 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 94.2 p -141.01 157.14 67.84 Favored Pre-proline 0 CA--C 1.55 0.98 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -179.007 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -69.84 162.58 84.05 Favored 'Cis proline' 0 C--N 1.353 0.809 0 CA-C-N 118.919 0.65 . . . . 0.0 111.279 -9.349 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.33 -34.1 71.94 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 171.886 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 53.2 tp -140.16 122.91 16.4 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.433 1.493 . . . . 0.0 109.41 172.194 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.9 tp -105.16 127.23 52.81 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.76 1.624 . . . . 0.0 109.186 171.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.8 t -111.05 124.5 67.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 123.912 0.885 . . . . 0.0 108.879 172.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.1 m -129.38 168.14 23.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 C-N-CA 124.935 1.294 . . . . 0.0 111.567 172.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 23.4 m -92.33 151.67 20.17 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.165 1.386 . . . . 0.0 110.44 173.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -52.13 123.89 11.68 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.436 1.094 . . . . 0.0 110.7 169.026 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 89.5 -2.92 83.43 Favored Glycine 0 CA--C 1.533 1.16 0 C-N-CA 125.616 1.579 . . . . 0.0 114.762 -177.614 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -91.31 158.39 16.58 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 119.393 1.597 . . . . 0.0 112.012 175.646 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -87.65 123.59 32.65 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.171 0.988 . . . . 0.0 110.901 178.555 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -101.59 129.96 47.81 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.955 1.302 . . . . 0.0 110.534 177.072 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 27.1 m -131.7 128.02 38.09 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.407 1.083 . . . . 0.0 111.021 177.919 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -102.8 154.5 19.12 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 126.628 1.971 . . . . 0.0 110.505 169.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 65.4 m -107.37 134.15 50.85 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.172 1.389 . . . . 0.0 109.001 170.706 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 73.2 m -130.05 114.73 16.14 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.653 1.181 . . . . 0.0 110.337 175.575 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 22.6 t -97.4 154.65 17.33 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 125.142 1.377 . . . . 0.0 110.237 179.61 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 53.8 m-85 -147.44 156.31 42.75 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.742 1.217 . . . . 0.0 113.979 -169.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 24.0 t -130.09 129.6 43.78 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.795 1.238 . . . . 0.0 108.726 168.429 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 63.0 m-80 -143.33 121.74 12.38 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.543 1.137 . . . . 0.0 111.209 -178.155 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 23.4 m -76.23 -30.48 57.95 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.89 1.276 . . . . 0.0 110.575 169.28 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.7 m -53.32 134.07 39.81 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 127.608 2.363 . . . . 0.0 113.126 177.661 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -63.02 -26.15 68.71 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.672 1.589 . . . . 0.0 112.921 -179.076 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.4 t -160.8 161.02 31.9 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.043 1.737 . . . . 0.0 110.475 171.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 38.5 p90 -163.69 158.14 20.04 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.335 1.454 . . . . 0.0 112.031 -169.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.7 t -95.95 133.08 38.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 125.513 1.525 . . . . 0.0 108.178 169.763 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.32 129.46 45.53 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.445 1.098 . . . . 0.0 108.694 169.264 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 -125.52 147.75 49.14 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.108 1.363 . . . . 0.0 111.133 179.081 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 18.9 t90 -122.02 139.39 53.75 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.482 1.113 . . . . 0.0 111.473 176.861 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -135.44 144.84 46.68 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.496 1.118 . . . . 0.0 113.859 -170.739 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.4 ttt-85 -106.54 134.97 48.86 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.516 1.126 . . . . 0.0 108.85 167.556 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.95 130.36 34.49 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.679 1.592 . . . . 0.0 110.614 170.643 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 19.0 m -104.31 158.79 31.2 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 126.014 1.725 . . . . 0.0 111.727 179.648 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -67.71 -17.42 47.65 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 123.986 3.124 . . . . 0.0 113.98 -174.625 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 70.6 m -80.08 21.94 0.55 Allowed 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 124.33 1.052 . . . . 0.0 112.28 168.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . 0.274 0.9 OUTLIER 54.31 33.85 19.28 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 128.147 2.579 . . . . 0.0 114.561 179.265 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -118.01 158.9 24.12 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.793 1.237 . . . . 0.0 111.397 178.737 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.3 p -113.0 144.35 42.74 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 125.815 1.646 . . . . 0.0 109.79 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -129.04 130.69 46.91 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 123.636 0.774 . . . . 0.0 111.313 177.91 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 32.0 ttmt -74.24 121.15 20.82 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.688 1.195 . . . . 0.0 110.355 -178.065 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 80.2 mt -94.48 -47.57 6.5 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 125.51 1.524 . . . . 0.0 111.911 -170.752 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -167.84 170.5 10.67 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 127.287 2.235 . . . . 0.0 109.18 -177.461 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.65 161.78 35.04 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.181 0.992 . . . . 0.0 112.451 -171.124 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -144.18 118.5 5.92 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.872 1.269 . . . . 0.0 111.131 169.879 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -53.54 155.74 14.7 Favored 'Cis proline' 0 C--N 1.352 0.715 0 CA-C-N 120.027 1.045 . . . . 0.0 112.166 -11.571 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -72.09 94.53 1.53 Allowed 'General case' 0 CA--C 1.544 0.727 0 CA-C-O 123.223 1.487 . . . . 0.0 111.966 -171.721 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -78.45 4.91 11.9 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 127.027 2.131 . . . . 0.0 113.967 -173.311 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 5.0 ppt_? -68.36 -31.58 71.05 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.345 1.458 . . . . 0.0 113.055 174.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.5 m 65.33 -26.21 0.1 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 128.3 2.64 . . . . 0.0 117.435 169.723 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 56.7 mm-40 -135.71 165.77 33.55 Favored Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 126.683 1.993 . . . . 0.0 110.816 -170.527 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.16 161.57 45.51 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 123.039 2.493 . . . . 0.0 111.472 171.796 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 107.41 -0.21 34.92 Favored Glycine 0 CA--C 1.535 1.281 0 C-N-CA 124.932 1.254 . . . . 0.0 113.635 -172.727 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 50.6 tp60 -63.9 129.11 38.73 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.261 1.424 . . . . 0.0 110.368 169.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -75.82 137.21 40.35 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.605 0.762 . . . . 0.0 110.902 174.66 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 55.9 p -76.73 -14.49 59.94 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 114.803 1.409 . . . . 0.0 114.803 -173.433 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 12.2 ptp180 -71.57 -29.8 65.14 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 119.486 1.039 . . . . 0.0 113.179 -175.89 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -93.77 137.42 33.03 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.49 1.116 . . . . 0.0 112.171 -173.173 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 72.1 mtm180 -140.72 151.51 44.56 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.804 1.241 . . . . 0.0 112.607 -179.187 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 59.0 t -126.51 126.65 69.37 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 126.078 1.751 . . . . 0.0 109.002 169.035 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 99.5 m -118.53 132.55 56.21 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.736 1.614 . . . . 0.0 109.78 176.588 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.17 141.74 28.32 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.617 1.167 . . . . 0.0 111.949 176.572 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 32.1 mt -97.77 157.98 33.74 Favored Pre-proline 0 CA--C 1.544 0.723 0 C-N-CA 123.749 0.82 . . . . 0.0 111.149 175.421 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -65.66 -5.02 10.81 Favored 'Trans proline' 0 CA--C 1.541 0.858 0 C-N-CA 123.411 2.741 . . . . 0.0 114.369 177.262 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -66.53 -25.99 66.93 Favored 'General case' 0 CA--C 1.55 0.947 0 CA-C-N 119.793 1.178 . . . . 0.0 112.428 169.504 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 86.68 -27.27 5.94 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 125.619 1.58 . . . . 0.0 114.04 178.342 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -130.91 73.34 1.54 Allowed 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 122.849 1.309 . . . . 0.0 108.664 171.509 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 13.2 t0 178.99 136.57 0.09 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.907 2.083 . . . . 0.0 108.596 -173.676 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -148.59 152.23 36.4 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.86 0.864 . . . . 0.0 112.773 -168.062 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 -113.62 127.06 55.92 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.169 1.388 . . . . 0.0 109.63 168.387 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 2.4 mpt? -119.1 136.51 54.12 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.622 1.169 . . . . 0.0 109.684 -179.191 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 50.4 p -141.98 147.3 36.74 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 116.122 1.897 . . . . 0.0 116.122 -169.481 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 21.9 t -103.52 109.09 26.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 126.642 1.977 . . . . 0.0 107.302 170.021 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 91.9 t -76.11 127.55 37.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 124.493 1.117 . . . . 0.0 109.423 175.632 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 53.6 ttt85 53.88 59.5 4.24 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.147 1.379 . . . . 0.0 110.955 176.852 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.47 150.7 47.91 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.836 0.854 . . . . 0.0 112.434 -171.537 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.95 162.63 31.53 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.934 1.693 . . . . 0.0 110.686 -179.406 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 76.9 mtm180 -55.88 -22.37 25.11 Favored 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 114.474 1.287 . . . . 0.0 114.474 -177.421 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -55.28 -37.96 67.98 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.846 1.258 . . . . 0.0 112.835 168.254 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -80.97 -26.16 36.8 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.215 1.006 . . . . 0.0 113.096 -169.118 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 46.4 m -49.74 138.41 14.56 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.935 1.294 . . . . 0.0 112.963 178.177 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 155.7 -164.26 32.08 Favored Glycine 0 N--CA 1.472 1.037 0 C-N-CA 123.88 0.753 . . . . 0.0 113.198 -176.833 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 21.9 m -89.95 144.61 25.77 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.276 1.031 . . . . 0.0 109.293 175.479 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 34.2 m-85 -135.65 158.36 44.57 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.6 1.56 . . . . 0.0 112.174 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -160.87 151.9 18.74 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 124.953 1.301 . . . . 0.0 112.3 175.26 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 85.3 m -103.39 170.76 7.76 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.787 1.235 . . . . 0.0 110.969 173.073 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -164.82 140.24 6.3 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 121.258 -0.901 . . . . 0.0 114.078 172.215 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -104.34 142.98 33.61 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.562 1.145 . . . . 0.0 111.124 173.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.0 tt -145.47 134.42 17.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 124.209 1.003 . . . . 0.0 111.057 176.59 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 2.2 m -64.24 160.88 17.66 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.735 1.214 . . . . 0.0 112.828 -179.508 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 37.2 mt -72.46 -17.57 61.76 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 -178.19 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -69.1 148.92 97.77 Favored Pre-proline 0 CA--C 1.551 0.998 0 C-N-CA 124.522 1.129 . . . . 0.0 112.48 178.137 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -69.55 -20.29 36.0 Favored 'Trans proline' 0 CA--C 1.539 0.764 0 C-N-CA 123.144 2.563 . . . . 0.0 113.214 179.579 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -83.04 0.44 44.85 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 124.803 1.241 . . . . 0.0 113.97 178.126 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.9 167.98 14.56 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.126 1.371 . . . . 0.0 113.928 -175.848 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -145.77 152.01 38.87 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.81 1.644 . . . . 0.0 109.546 177.044 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 51.2 mt -75.57 126.95 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 124.187 0.995 . . . . 0.0 111.215 -174.53 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -78.4 88.49 4.4 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.767 1.227 . . . . 0.0 109.967 169.723 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -83.79 158.78 21.59 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.914 1.285 . . . . 0.0 111.154 175.83 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 6.7 t -148.61 -170.0 3.5 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.201 1.0 . . . . 0.0 112.152 173.745 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 98.8 mt -60.5 128.82 38.55 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.193 1.797 . . . . 0.0 111.754 -174.479 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.43 154.45 41.34 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.758 1.223 . . . . 0.0 112.73 -171.979 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.84 167.16 11.19 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 127.069 2.148 . . . . 0.0 110.234 174.239 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -135.06 143.41 46.68 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.026 -1.046 . . . . 0.0 111.781 179.26 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 60.6 tp -112.17 134.14 53.89 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 125.922 1.689 . . . . 0.0 110.3 172.49 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 70.8 ttt180 -124.87 117.96 25.26 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.501 1.52 . . . . 0.0 109.615 169.545 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 29.5 t -100.53 117.7 46.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 124.37 1.068 . . . . 0.0 108.685 169.605 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 66.8 p -97.44 154.65 17.34 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.698 1.599 . . . . 0.0 111.056 179.4 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -62.02 141.98 57.76 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.527 0.731 . . . . 0.0 112.629 -176.523 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 51.8 ttt85 -75.84 116.88 17.0 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.914 0.885 . . . . 0.0 110.164 -178.005 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 44.9 ptt85 -70.61 150.25 46.23 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.761 0.824 . . . . 0.0 113.056 -175.887 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -89.51 124.85 34.89 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.322 1.049 . . . . 0.0 109.055 168.572 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 . . . . . 0 N--CA 1.487 1.392 0 C-N-CA 128.342 2.657 . . . . 0.0 112.388 -170.98 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 2.1 tmt? . . . . . 0 N--CA 1.488 1.473 0 CA-C-O 118.687 -0.673 . . . . 0.0 110.188 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_endo -83.24 152.12 13.9 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.569 2.846 . . . . 0.0 111.124 177.269 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -65.13 130.78 26.56 Favored 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 122.687 2.258 . . . . 0.0 110.007 172.938 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 37.8 m -139.8 148.16 41.79 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.926 0.891 . . . . 0.0 111.378 -169.345 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -116.8 129.23 55.97 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.6 1.96 . . . . 0.0 109.576 170.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 67.8 m -140.79 158.94 64.24 Favored Pre-proline 0 N--CA 1.479 0.98 0 C-N-CA 124.543 1.137 . . . . 0.0 113.14 -170.062 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -67.75 157.5 85.46 Favored 'Cis proline' 0 C--N 1.354 0.833 0 CA-C-N 119.938 1.014 . . . . 0.0 111.398 -5.383 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -55.03 -25.92 33.67 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.109 0.963 . . . . 0.0 113.5 176.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 43.3 tp -143.5 116.18 8.69 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.582 1.553 . . . . 0.0 108.441 168.698 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 38.0 tp -97.32 127.47 43.31 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.416 1.086 . . . . 0.0 109.018 169.848 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.8 t -114.04 123.14 69.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 124.067 0.947 . . . . 0.0 108.662 173.232 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 32.6 m -127.03 162.52 31.72 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 124.529 1.132 . . . . 0.0 112.134 174.013 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 11.6 m -87.52 148.65 24.82 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.378 1.071 . . . . 0.0 110.502 173.076 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -59.2 125.7 24.69 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.019 0.928 . . . . 0.0 111.753 -179.254 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.66 -3.49 85.02 Favored Glycine 0 CA--C 1.532 1.11 0 C-N-CA 125.805 1.669 . . . . 0.0 114.51 -175.433 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -85.35 156.03 21.07 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 119.601 1.7 . . . . 0.0 110.814 171.744 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -82.46 134.81 35.22 Favored 'General case' 0 CA--C 1.543 0.68 0 O-C-N 121.405 -0.809 . . . . 0.0 111.24 171.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -104.47 123.64 47.84 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.713 1.605 . . . . 0.0 110.052 177.342 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 94.7 m -122.9 125.22 44.93 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.41 0.684 . . . . 0.0 110.985 176.911 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -102.82 159.6 15.34 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 127.264 2.225 . . . . 0.0 110.522 174.363 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 80.6 m -105.71 130.08 53.79 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.854 1.261 . . . . 0.0 109.997 170.42 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 54.0 t -110.29 140.5 44.39 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.382 1.473 . . . . 0.0 109.814 168.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 6.1 t -144.38 132.24 21.38 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.355 -0.84 . . . . 0.0 110.534 -178.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -127.32 139.29 52.98 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 125.645 1.578 . . . . 0.0 113.636 -177.217 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 29.3 t -93.58 117.9 30.68 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 165.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 41.2 t-20 -157.13 131.68 8.63 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.684 -0.635 . . . . 0.0 111.762 -169.26 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 29.1 p -91.47 -13.56 32.03 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 126.182 1.793 . . . . 0.0 113.84 -178.76 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 70.3 m -68.58 129.95 41.43 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.353 1.061 . . . . 0.0 111.507 178.377 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -63.71 -26.95 68.89 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.05 1.34 . . . . 0.0 112.788 -179.675 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 21.2 t -151.18 146.19 25.93 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.999 1.319 . . . . 0.0 110.777 171.139 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 52.4 p90 -163.91 159.06 20.52 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.17 1.788 . . . . 0.0 110.611 -175.378 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 50.4 t -95.92 125.22 48.78 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.43 1.092 . . . . 0.0 108.268 174.098 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 58.6 tp -101.57 128.9 47.62 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.388 0.675 . . . . 0.0 109.557 169.887 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 28.8 m-80 -116.64 163.17 16.51 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.637 1.575 . . . . 0.0 111.154 -175.777 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 19.8 t90 -133.19 138.88 46.73 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.756 1.222 . . . . 0.0 111.832 -178.376 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -137.43 146.56 44.51 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.291 1.436 . . . . 0.0 113.717 -172.073 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 27.7 ttp-105 -104.12 142.62 34.17 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.949 1.7 . . . . 0.0 107.727 167.383 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 35.4 mtp -88.27 131.47 34.77 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 119.077 0.853 . . . . 0.0 111.027 170.075 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 37.9 m -92.65 155.56 41.84 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 124.807 1.243 . . . . 0.0 111.43 175.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -66.67 -19.32 53.88 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 123.566 2.844 . . . . 0.0 113.775 -175.22 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.7 m -76.94 8.54 3.69 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 124.753 1.221 . . . . 0.0 113.277 171.395 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 26.4 m120 73.29 21.01 3.13 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 127.851 2.46 . . . . 0.0 113.37 179.231 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 21.9 mm100 -96.7 175.37 6.4 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.669 1.187 . . . . 0.0 111.265 174.813 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.2 p -126.53 139.84 52.9 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.976 1.71 . . . . 0.0 109.795 175.251 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 41.3 t0 -120.57 130.68 54.31 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 125.323 1.449 . . . . 0.0 110.667 -177.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 41.7 tttm -82.79 123.12 29.04 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.454 1.102 . . . . 0.0 111.415 -171.435 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.5 mt -100.37 -45.65 5.51 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.77 1.228 . . . . 0.0 112.912 -169.069 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -174.05 176.71 2.5 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.337 1.855 . . . . 0.0 110.353 -178.778 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -157.75 166.29 33.15 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.959 1.303 . . . . 0.0 112.136 -179.583 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 21.2 t80 -142.17 122.24 8.18 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 125.087 1.355 . . . . 0.0 110.503 172.586 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -60.63 154.42 52.72 Favored 'Cis proline' 0 C--N 1.352 0.715 0 CA-C-N 119.534 0.869 . . . . 0.0 110.92 -9.363 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -62.68 97.76 0.11 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.611 1.165 . . . . 0.0 114.005 -169.23 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -77.99 44.19 0.47 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 127.085 2.154 . . . . 0.0 111.125 169.599 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 16.2 ttt180 -70.79 -1.57 11.99 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 115.019 1.489 . . . . 0.0 115.019 -169.192 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 18.9 m -67.51 -22.5 65.44 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.759 1.224 . . . . 0.0 113.39 174.09 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 64.0 mm-40 -83.35 145.85 49.42 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 123.712 0.805 . . . . 0.0 111.106 175.601 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -76.58 158.24 36.01 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.507 2.805 . . . . 0.0 112.877 -173.624 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 98.26 -7.18 61.94 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 125.638 1.59 . . . . 0.0 112.911 177.743 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -92.35 61.13 3.78 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.269 1.028 . . . . 0.0 112.17 -169.775 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -74.14 160.46 31.18 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 124.695 1.198 . . . . 0.0 113.588 178.795 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 20.7 m -70.02 -3.66 17.34 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 116.389 1.996 . . . . 0.0 116.389 -168.452 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 50.6 mtp180 -70.45 -29.66 66.3 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 119.465 1.03 . . . . 0.0 112.049 170.329 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 88.6 m-85 -103.23 128.3 50.27 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.554 1.542 . . . . 0.0 110.903 -175.665 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -142.02 148.04 37.86 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.766 1.227 . . . . 0.0 111.406 -170.44 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 40.9 t -126.62 136.9 59.47 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 124.976 1.311 . . . . 0.0 110.784 178.497 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 98.0 m -127.81 132.74 49.43 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.494 1.518 . . . . 0.0 110.212 175.312 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -85.12 136.48 33.53 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.08 0.952 . . . . 0.0 110.46 172.11 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 29.5 mt -89.59 159.25 44.22 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 124.135 0.974 . . . . 0.0 111.461 176.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -63.65 -6.03 9.83 Favored 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 123.489 2.793 . . . . 0.0 114.216 175.097 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -66.55 -18.99 65.67 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-N 119.224 0.92 . . . . 0.0 112.953 169.391 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 82.72 -34.18 2.76 Favored Glycine 0 N--CA 1.474 1.2 0 C-N-CA 127.386 2.422 . . . . 0.0 114.326 174.222 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 38.1 mtm105 -128.25 73.56 1.49 Allowed 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.097 1.359 . . . . 0.0 108.574 168.534 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -174.22 137.68 0.54 Allowed 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 127.743 2.417 . . . . 0.0 108.03 177.514 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -146.03 148.5 32.77 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 123.461 0.705 . . . . 0.0 112.209 -168.037 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 42.6 m170 -105.43 130.2 53.57 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.71 1.204 . . . . 0.0 111.203 169.325 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -112.0 119.31 38.04 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 126.311 1.844 . . . . 0.0 108.565 178.088 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 60.8 m -121.44 125.66 47.42 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 -169.479 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 25.8 t -96.35 111.11 25.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 125.773 1.629 . . . . 0.0 106.693 168.185 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 62.6 t -81.48 127.92 39.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 123.543 0.737 . . . . 0.0 109.766 177.536 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 68.0 ttt-85 57.15 67.61 0.96 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.821 1.649 . . . . 0.0 111.273 176.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -72.53 144.42 47.97 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.851 0.86 . . . . 0.0 112.289 -174.137 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 49.0 mmm-85 -123.15 162.23 22.91 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 126.625 1.97 . . . . 0.0 110.352 -177.092 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 77.2 mtm180 -55.66 -23.11 26.33 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 113.66 0.985 . . . . 0.0 113.66 174.889 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -54.06 -35.67 62.28 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.766 1.626 . . . . 0.0 113.586 168.271 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -87.69 -15.09 38.12 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.304 1.042 . . . . 0.0 113.72 -168.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 50.2 m -58.04 134.66 56.61 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 119.696 1.135 . . . . 0.0 112.273 177.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 146.94 -163.97 28.59 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 124.496 1.046 . . . . 0.0 113.316 -171.783 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.8 m -95.08 144.85 25.4 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.586 1.154 . . . . 0.0 111.783 -173.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -140.5 156.92 46.18 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.394 1.877 . . . . 0.0 112.254 -179.097 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -164.07 159.16 20.19 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.797 1.639 . . . . 0.0 112.372 179.664 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 7.3 p -112.49 162.99 15.0 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.543 1.137 . . . . 0.0 112.115 176.037 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -153.35 126.23 1.92 Allowed Glycine 0 N--CA 1.471 1.026 0 O-C-N 121.304 -0.872 . . . . 0.0 114.287 -176.569 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -97.23 148.78 22.75 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.484 1.114 . . . . 0.0 112.715 -177.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 17.8 tt -150.27 138.8 14.78 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 125.402 1.481 . . . . 0.0 110.532 175.788 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 47.4 t -65.2 158.15 26.91 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.451 -0.781 . . . . 0.0 112.72 176.427 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -71.76 -8.04 51.79 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 172.542 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -69.77 147.59 96.3 Favored Pre-proline 0 CA--C 1.552 1.04 0 C-N-CA 124.453 1.101 . . . . 0.0 112.275 175.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -71.02 -21.24 27.9 Favored 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 123.17 2.58 . . . . 0.0 113.311 -179.113 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -87.74 3.5 47.78 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.735 1.214 . . . . 0.0 113.821 179.529 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.76 167.31 17.42 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.147 1.379 . . . . 0.0 114.126 -173.689 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -150.45 148.86 29.26 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.221 1.808 . . . . 0.0 109.169 178.556 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 47.8 mt -77.15 131.12 35.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 124.219 1.008 . . . . 0.0 112.031 -170.383 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -101.32 117.11 34.31 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.594 1.557 . . . . 0.0 108.284 168.67 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -94.93 148.86 21.87 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.235 1.014 . . . . 0.0 112.134 -174.452 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 52.9 p -83.91 169.22 15.29 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.693 1.197 . . . . 0.0 114.074 178.224 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 94.5 mt -69.06 129.99 41.48 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 166.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 34.3 ptt-85 -84.68 164.15 18.79 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.931 1.292 . . . . 0.0 113.749 -169.683 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -146.93 163.13 37.14 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.283 1.433 . . . . 0.0 113.488 -177.882 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -99.13 151.48 20.93 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.726 1.61 . . . . 0.0 112.798 -176.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 61.5 tp -125.58 136.49 53.35 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 126.857 2.063 . . . . 0.0 109.851 169.674 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -128.11 120.46 27.44 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.7 1.6 . . . . 0.0 109.93 174.031 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 42.9 t -101.95 116.93 46.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 124.512 1.125 . . . . 0.0 108.752 169.721 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 82.8 p -101.98 145.37 29.37 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.653 1.581 . . . . 0.0 110.716 -178.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -55.36 145.22 22.78 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -175.797 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 63.7 ttt-85 -94.26 141.78 28.17 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 125.209 1.404 . . . . 0.0 109.772 175.675 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 35.4 ttp-105 -66.18 150.71 48.35 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.905 0.882 . . . . 0.0 110.885 170.799 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -75.22 102.35 4.97 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.527 0.731 . . . . 0.0 109.666 170.464 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 . . . . . 0 C--O 1.255 1.355 0 C-N-CA 125.563 1.545 . . . . 0.0 112.542 -169.774 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 16.4 tpt . . . . . 0 N--CA 1.49 1.54 0 CA-C-O 116.28 -1.819 . . . . 0.0 113.05 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -61.88 158.04 40.23 Favored 'Trans proline' 0 C--N 1.358 1.072 0 C-N-CA 122.459 2.106 . . . . 0.0 113.218 178.899 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -59.08 155.55 38.84 Favored 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 123.804 3.003 . . . . 0.0 114.564 175.854 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.2 t -163.55 159.16 21.61 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.017 1.327 . . . . 0.0 112.202 174.802 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -144.97 117.67 8.67 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.347 1.859 . . . . 0.0 109.619 175.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 96.9 p -140.94 161.72 52.29 Favored Pre-proline 0 CA--C 1.55 0.969 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 -169.684 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -71.71 164.26 84.65 Favored 'Cis proline' 0 C--N 1.354 0.826 0 CA-C-N 119.45 0.839 . . . . 0.0 111.762 -7.791 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.66 -26.06 68.49 Favored 'General case' 0 CA--C 1.544 0.75 0 N-CA-C 113.048 0.759 . . . . 0.0 113.048 173.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 50.7 tp -144.3 125.68 14.8 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.192 1.797 . . . . 0.0 109.326 172.872 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 64.7 tp -115.29 125.61 53.48 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.987 1.715 . . . . 0.0 109.266 174.304 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.9 t -110.25 122.98 65.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 124.144 0.978 . . . . 0.0 109.16 175.038 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 32.0 m -129.2 176.22 8.75 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 125.753 1.621 . . . . 0.0 111.861 176.456 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 26.1 m -103.95 151.68 22.88 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 126.08 1.752 . . . . 0.0 110.402 176.034 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -53.51 121.98 8.82 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.294 1.038 . . . . 0.0 111.777 171.72 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.0 2.36 69.1 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 125.442 1.496 . . . . 0.0 114.407 -177.089 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -93.85 149.37 21.29 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.665 1.732 . . . . 0.0 112.544 177.588 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -72.93 113.22 9.72 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.255 1.022 . . . . 0.0 110.757 172.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -97.5 124.99 41.92 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.79 0.836 . . . . 0.0 110.514 177.63 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 32.1 m -129.53 123.27 31.02 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 118.633 0.651 . . . . 0.0 111.53 -173.525 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -101.55 149.81 23.72 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.609 1.564 . . . . 0.0 110.371 169.651 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 62.1 m -102.67 126.34 49.73 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.985 1.314 . . . . 0.0 109.475 177.454 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 37.5 t -124.33 142.05 51.58 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.147 1.379 . . . . 0.0 112.314 175.514 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 80.7 p -150.59 148.79 29.07 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.146 -0.971 . . . . 0.0 112.133 170.327 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -139.2 156.12 47.33 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.822 2.049 . . . . 0.0 111.962 178.486 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 70.9 m -132.64 142.84 49.29 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.245 1.418 . . . . 0.0 109.247 168.481 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 53.7 m-80 -137.66 156.26 48.23 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.811 1.245 . . . . 0.0 111.827 -176.716 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 19.6 p -74.03 -34.0 63.95 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.465 1.506 . . . . 0.0 112.189 174.149 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 13.1 m -65.02 152.14 44.18 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.841 1.656 . . . . 0.0 112.269 172.734 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -68.61 -14.73 63.2 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 114.741 1.386 . . . . 0.0 114.741 -175.111 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 13.3 m -166.36 159.53 14.84 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 126.529 1.932 . . . . 0.0 111.376 178.576 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 55.5 p90 -156.62 157.41 35.22 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.878 1.271 . . . . 0.0 112.475 -176.413 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.7 t -96.03 129.02 46.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 125.179 1.392 . . . . 0.0 107.995 170.058 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 34.1 tp -99.37 140.29 33.77 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.222 1.009 . . . . 0.0 109.968 171.294 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -135.49 146.37 48.08 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.337 1.455 . . . . 0.0 111.02 -170.75 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 17.3 t90 -118.37 139.9 50.67 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.031 1.332 . . . . 0.0 111.297 177.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -136.99 147.7 46.44 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.725 1.21 . . . . 0.0 113.783 -172.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 74.4 ttt180 -105.68 140.06 39.31 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.41 1.484 . . . . 0.0 108.315 167.503 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 29.8 mtp -81.82 145.92 30.16 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.011 0.823 . . . . 0.0 112.414 177.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 67.7 m -104.68 148.91 36.83 Favored Pre-proline 0 CA--C 1.544 0.745 0 C-N-CA 125.657 1.583 . . . . 0.0 110.793 173.408 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -67.16 -17.9 50.73 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 123.682 2.921 . . . . 0.0 113.278 -177.715 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 12.0 m -76.87 19.25 0.3 Allowed 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 125.759 1.624 . . . . 0.0 113.29 171.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 44.8 m-80 68.63 33.84 3.72 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 127.425 2.29 . . . . 0.0 112.587 177.01 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -130.06 -172.68 2.84 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.453 1.501 . . . . 0.0 110.798 -172.121 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.1 p -148.01 145.12 28.38 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.909 1.684 . . . . 0.0 110.215 -171.494 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -120.12 131.61 55.11 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 124.638 1.175 . . . . 0.0 111.002 175.281 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -76.17 129.51 36.85 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.561 0.744 . . . . 0.0 111.307 -179.359 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 55.7 mt -101.98 -51.25 3.45 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 125.473 1.509 . . . . 0.0 111.406 -173.165 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -163.4 173.55 13.05 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.822 1.649 . . . . 0.0 110.387 -175.37 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.6 168.39 26.21 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.508 1.123 . . . . 0.0 112.759 -174.871 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 52.3 t80 -142.73 122.8 7.98 Favored Pre-proline 0 CA--C 1.546 0.8 0 C-N-CA 124.992 1.317 . . . . 0.0 110.332 169.439 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -62.92 159.33 61.83 Favored 'Cis proline' 0 C--N 1.351 0.705 0 CA-C-N 119.683 0.922 . . . . 0.0 111.399 -8.648 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -76.59 94.64 3.78 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 121.932 0.873 . . . . 0.0 110.997 -177.503 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -82.4 0.88 40.0 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.889 1.676 . . . . 0.0 114.225 -177.707 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 52.3 ptt85 -63.91 -23.63 67.42 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.717 1.607 . . . . 0.0 114.253 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 25.3 p 69.71 -35.28 0.31 Allowed 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 129.333 3.053 . . . . 0.0 115.464 177.587 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -135.74 161.92 60.0 Favored Pre-proline 0 CA--C 1.546 0.811 0 C-N-CA 126.104 1.762 . . . . 0.0 111.485 -169.306 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -79.8 -177.44 3.84 Favored 'Trans proline' 0 CA--C 1.542 0.91 0 C-N-CA 124.313 3.342 . . . . 0.0 111.557 172.233 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 121.9 -5.06 10.58 Favored Glycine 0 CA--C 1.534 1.239 0 C-N-CA 124.995 1.283 . . . . 0.0 114.772 176.199 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -80.22 164.84 22.94 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.147 0.979 . . . . 0.0 111.916 171.376 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -73.41 157.74 36.31 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.359 1.064 . . . . 0.0 112.92 172.522 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 17.7 m -80.33 -7.88 59.25 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 115.517 1.673 . . . . 0.0 115.517 -169.693 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -69.54 -47.48 63.56 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 119.706 1.139 . . . . 0.0 113.693 -169.414 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -90.15 124.94 35.25 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.04 0.936 . . . . 0.0 112.944 -168.111 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 23.4 mmt85 -129.82 156.63 44.03 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.84 1.656 . . . . 0.0 111.831 178.137 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 87.7 t -126.6 130.53 71.69 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 C-N-CA 125.65 1.58 . . . . 0.0 109.771 169.774 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 97.8 m -126.0 132.0 52.11 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 125.08 1.352 . . . . 0.0 110.16 177.489 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 63.0 tt0 -84.64 138.02 32.93 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.597 1.159 . . . . 0.0 111.043 177.465 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 28.6 mt -91.55 162.37 31.78 Favored Pre-proline 0 CA--C 1.548 0.877 0 C-N-CA 124.102 0.961 . . . . 0.0 112.063 176.31 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -56.03 -20.88 32.02 Favored 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 124.213 3.276 . . . . 0.0 114.211 172.605 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 21.7 m120 -60.74 -18.44 54.6 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 176.627 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 90.48 -34.06 4.32 Favored Glycine 0 N--CA 1.474 1.196 0 C-N-CA 126.569 2.033 . . . . 0.0 114.549 169.878 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 26.0 ptt-85 -138.8 73.58 1.44 Allowed 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 123.883 1.802 . . . . 0.0 109.72 168.458 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -164.53 137.33 4.84 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 127.872 2.469 . . . . 0.0 106.52 -179.058 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -144.75 143.47 30.69 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -166.628 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -96.69 116.03 28.43 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.973 1.309 . . . . 0.0 110.322 168.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -94.55 108.05 20.01 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 126.558 1.943 . . . . 0.0 107.621 174.336 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 19.4 m -116.51 126.99 54.14 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.847 1.055 . . . . 0.0 113.847 -167.488 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 21.3 t -94.66 104.83 16.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 N-CA-C 106.722 -1.584 . . . . 0.0 106.722 168.051 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 81.0 t -70.4 121.08 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 124.647 1.179 . . . . 0.0 109.731 179.442 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 51.87 57.27 6.7 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.793 1.637 . . . . 0.0 112.039 176.32 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -59.57 140.04 56.66 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.254 1.422 . . . . 0.0 112.056 -173.086 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 19.8 mmm-85 -115.05 168.31 10.04 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.641 1.576 . . . . 0.0 110.508 177.757 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 59.0 mtp85 -51.2 -35.29 35.78 Favored 'General case' 0 N--CA 1.479 0.997 0 O-C-N 121.023 -1.048 . . . . 0.0 112.855 176.149 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -57.43 -22.59 44.26 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.14 1.776 . . . . 0.0 114.994 173.115 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -86.68 -10.88 52.78 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.774 1.229 . . . . 0.0 113.53 177.042 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 65.4 m -63.97 137.74 58.14 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 120.196 -1.565 . . . . 0.0 112.312 -179.435 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 152.23 -166.7 31.14 Favored Glycine 0 N--CA 1.47 0.901 0 C-N-CA 123.996 0.808 . . . . 0.0 113.298 -179.514 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.6 m -93.63 141.79 28.08 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.367 1.067 . . . . 0.0 110.467 -176.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -136.05 160.12 39.6 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.548 1.939 . . . . 0.0 110.972 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.7 pp -154.09 163.52 39.96 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 121.12 -0.988 . . . . 0.0 112.262 174.036 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 34.6 t -124.59 141.18 52.29 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.288 1.435 . . . . 0.0 110.494 -177.125 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -150.24 143.78 11.11 Favored Glycine 0 N--CA 1.47 0.96 0 N-CA-C 114.938 0.735 . . . . 0.0 114.938 -175.854 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -115.86 154.3 29.96 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.009 1.324 . . . . 0.0 113.04 -177.668 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 17.2 tt -146.64 133.29 13.85 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 125.344 1.458 . . . . 0.0 110.469 176.273 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 31.7 p -71.47 161.55 30.85 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.124 0.97 . . . . 0.0 113.427 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 47.3 mt -75.22 -3.42 32.98 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 114.233 1.197 . . . . 0.0 114.233 -179.047 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -67.8 151.69 96.97 Favored Pre-proline 0 CA--C 1.551 0.986 0 C-N-CA 124.729 1.212 . . . . 0.0 112.612 178.193 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -69.29 -23.9 32.43 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 122.939 2.426 . . . . 0.0 112.693 175.908 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 57.2 mtmt -92.39 10.28 30.61 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.247 1.419 . . . . 0.0 113.591 178.566 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -64.23 161.62 16.18 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.815 1.246 . . . . 0.0 114.014 -175.411 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 25.9 tt0 -147.07 149.02 32.26 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.02 1.728 . . . . 0.0 109.105 179.037 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 58.1 mt -77.21 123.93 34.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 123.181 0.592 . . . . 0.0 110.967 -176.331 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -93.99 137.84 32.76 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.506 1.522 . . . . 0.0 108.709 168.19 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -120.06 142.41 48.88 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.098 0.959 . . . . 0.0 111.797 -175.29 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 23.7 m -89.65 167.13 13.16 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.192 0.997 . . . . 0.0 112.251 169.56 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.4 139.38 58.21 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.12 0.968 . . . . 0.0 110.665 176.202 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.57 151.88 44.55 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -172.838 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.87 161.12 19.25 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.062 1.745 . . . . 0.0 111.347 174.665 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -120.95 135.46 55.2 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.036 1.334 . . . . 0.0 110.016 176.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 46.3 tp -107.79 128.82 54.93 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 125.622 1.569 . . . . 0.0 109.724 173.498 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 4.5 tpm_? -123.83 113.14 18.14 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.122 1.769 . . . . 0.0 109.203 177.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 16.3 t -106.85 114.48 46.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 123.628 0.771 . . . . 0.0 109.799 176.652 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 70.2 p -95.25 159.27 15.09 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.43 1.892 . . . . 0.0 111.593 -176.665 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -67.57 141.48 56.8 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.433 0.693 . . . . 0.0 112.168 -178.184 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 68.9 ttp85 -84.1 131.37 34.8 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 124.419 1.088 . . . . 0.0 110.113 178.199 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 65.9 ttp85 -71.33 141.41 50.45 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.7 0.8 . . . . 0.0 111.495 179.745 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -73.8 154.32 39.58 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.551 1.14 . . . . 0.0 112.667 176.173 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 2.4 pp20? . . . . . 0 C--O 1.253 1.271 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 177.864 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 24.9 ptp . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 118.416 -0.802 . . . . 0.0 111.226 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -76.92 170.22 20.22 Favored 'Trans proline' 0 CA--C 1.545 1.07 0 C-N-CA 123.638 2.892 . . . . 0.0 111.811 174.311 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -55.18 153.58 26.22 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 124.244 3.296 . . . . 0.0 112.971 169.466 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 13.7 t -147.93 153.95 39.72 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.041 0.936 . . . . 0.0 112.023 -179.254 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -143.92 113.88 7.27 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 127.535 2.334 . . . . 0.0 107.982 178.332 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 95.1 p -140.83 159.61 61.71 Favored Pre-proline 0 CA--C 1.55 0.951 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 -168.662 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.22 161.72 84.06 Favored 'Cis proline' 0 C--N 1.355 0.916 0 CA-C-N 119.419 0.828 . . . . 0.0 111.598 -6.73 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.43 -27.86 69.29 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 175.062 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 tt -132.57 115.36 15.36 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 126.453 1.901 . . . . 0.0 108.71 173.847 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.7 tp -107.15 121.18 43.99 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.933 0.893 . . . . 0.0 109.63 172.092 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.0 t -106.38 125.54 62.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 124.132 0.973 . . . . 0.0 108.661 172.737 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.9 m -129.42 166.67 26.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 124.363 1.065 . . . . 0.0 111.422 169.804 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 73.6 m -88.76 150.33 23.0 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.26 1.024 . . . . 0.0 110.344 170.424 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -53.81 116.9 2.77 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.551 1.541 . . . . 0.0 111.313 173.335 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 89.67 8.31 67.82 Favored Glycine 0 CA--C 1.534 1.247 0 CA-C-O 118.547 -1.141 . . . . 0.0 114.62 -176.295 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -99.5 155.34 17.62 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 119.408 1.604 . . . . 0.0 111.96 171.484 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -78.5 119.56 21.96 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.99 0.916 . . . . 0.0 110.969 179.895 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -98.91 126.72 44.66 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.685 1.194 . . . . 0.0 110.749 175.941 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 97.7 m -132.78 125.6 30.49 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.774 0.83 . . . . 0.0 111.61 179.74 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -100.05 154.16 18.64 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.837 1.655 . . . . 0.0 109.441 168.191 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.3 m -106.52 134.26 49.93 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.689 1.195 . . . . 0.0 109.369 173.493 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 43.2 t -126.39 139.63 53.12 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.637 1.575 . . . . 0.0 111.959 176.156 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 99.2 p -151.23 153.38 34.79 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 121.437 -0.79 . . . . 0.0 112.132 170.594 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -130.58 156.14 45.36 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.787 1.635 . . . . 0.0 113.336 -174.778 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.8 m -113.19 116.2 29.43 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.106 1.363 . . . . 0.0 109.348 169.661 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 75.7 m-20 -139.36 140.2 37.41 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.5 1.52 . . . . 0.0 110.606 179.621 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 23.9 p -80.09 -21.53 43.22 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 125.807 1.643 . . . . 0.0 113.642 -175.755 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 32.0 p -74.94 165.22 25.6 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.121 1.369 . . . . 0.0 111.345 169.329 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -68.22 -31.72 71.43 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.279 1.432 . . . . 0.0 112.836 -173.436 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.3 t -163.12 171.03 16.97 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.903 1.281 . . . . 0.0 111.828 -176.504 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 35.6 p90 -161.09 162.46 31.59 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 126.185 1.794 . . . . 0.0 110.784 -170.02 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 79.2 t -95.87 123.14 47.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 170.091 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 22.3 tp -100.06 136.12 40.45 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.908 0.883 . . . . 0.0 109.776 176.564 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -130.71 154.69 47.68 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.689 1.596 . . . . 0.0 111.003 -169.746 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 19.3 t90 -130.9 137.68 49.43 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.755 1.222 . . . . 0.0 111.689 -177.351 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -136.15 146.43 46.89 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.53 1.132 . . . . 0.0 112.998 -173.058 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.6 ttt180 -103.71 140.88 37.0 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.962 1.305 . . . . 0.0 108.48 167.823 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 28.5 mtp -87.08 140.75 29.24 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.4 0.68 . . . . 0.0 111.931 176.719 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 48.6 m -91.94 157.62 40.98 Favored Pre-proline 0 CA--C 1.549 0.913 0 C-N-CA 124.714 1.206 . . . . 0.0 111.91 176.514 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -55.62 -34.01 88.85 Favored 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 123.957 3.104 . . . . 0.0 114.09 176.485 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.6 m -76.92 9.63 2.8 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.063 1.345 . . . . 0.0 113.855 176.935 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 26.5 m120 70.5 20.9 5.74 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 127.329 2.252 . . . . 0.0 113.386 -178.971 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -90.1 -172.67 3.57 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.555 1.142 . . . . 0.0 110.582 170.432 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.1 p -145.13 147.35 32.4 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.768 1.627 . . . . 0.0 110.488 -175.512 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -123.9 133.3 53.77 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 124.731 1.212 . . . . 0.0 111.235 174.16 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -79.92 118.8 22.0 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.916 0.886 . . . . 0.0 111.21 -178.03 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 61.8 mt -89.25 -53.75 4.42 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 125.002 1.321 . . . . 0.0 111.172 -173.709 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -165.4 172.15 12.55 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.854 1.662 . . . . 0.0 110.552 -174.797 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.59 167.81 27.6 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.27 1.428 . . . . 0.0 111.628 -178.094 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -156.22 135.08 7.67 Favored Pre-proline 0 CA--C 1.551 1.011 0 C-N-CA 123.998 0.919 . . . . 0.0 112.974 170.239 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -64.37 139.58 37.3 Favored 'Cis proline' 0 C--N 1.354 0.817 0 N-CA-C 108.98 -1.2 . . . . 0.0 108.98 -14.322 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -78.39 94.64 4.91 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 122.712 1.244 . . . . 0.0 113.218 -167.778 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -73.98 -5.47 41.5 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.177 1.391 . . . . 0.0 112.673 169.768 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 18.6 ttt180 -53.73 -52.74 59.16 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 127.444 2.298 . . . . 0.0 112.589 177.674 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.5 t 69.22 -47.69 0.59 Allowed 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 127.551 2.34 . . . . 0.0 114.558 -179.825 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -90.03 150.68 43.97 Favored Pre-proline 0 CA--C 1.548 0.883 0 C-N-CA 125.226 1.41 . . . . 0.0 112.924 -172.132 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_exo -62.03 -172.82 0.11 Allowed 'Trans proline' 0 CA--C 1.542 0.917 0 C-N-CA 124.535 3.49 . . . . 0.0 114.57 170.134 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 129.03 -12.63 6.09 Favored Glycine 0 N--CA 1.474 1.196 0 C-N-CA 125.534 1.54 . . . . 0.0 113.869 171.482 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -88.55 167.86 13.06 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.853 1.261 . . . . 0.0 111.775 169.868 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -93.99 151.37 19.59 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.621 0.769 . . . . 0.0 109.74 167.197 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 16.1 m -66.73 -7.82 23.69 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 -173.394 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 25.7 ptt-85 -84.37 -16.88 41.26 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 114.694 1.368 . . . . 0.0 114.694 179.034 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -91.02 117.74 29.82 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.47 1.108 . . . . 0.0 110.317 177.805 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -139.09 152.31 47.41 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.417 1.087 . . . . 0.0 112.343 -169.49 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 82.4 t -126.47 128.94 71.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 C-N-CA 125.841 1.656 . . . . 0.0 109.376 177.647 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 96.7 m -128.0 133.47 49.16 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.233 1.413 . . . . 0.0 110.332 -176.466 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -80.65 141.79 34.61 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.001 0.92 . . . . 0.0 112.136 176.608 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 27.2 mt -90.84 158.39 42.21 Favored Pre-proline 0 CA--C 1.545 0.764 0 C-N-CA 124.06 0.944 . . . . 0.0 111.456 172.172 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -65.23 -6.21 12.73 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.529 2.819 . . . . 0.0 114.18 174.623 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -63.0 -26.0 68.65 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 119.527 1.058 . . . . 0.0 112.66 169.436 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 98.69 -34.16 5.53 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 126.231 1.872 . . . . 0.0 114.379 172.611 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 40.6 mtm180 -136.22 73.65 1.47 Allowed 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 118.654 1.227 . . . . 0.0 109.837 170.41 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -168.81 139.83 2.49 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 128.254 2.622 . . . . 0.0 107.397 -176.861 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -143.44 149.85 38.19 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 114.457 1.28 . . . . 0.0 114.457 -167.92 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -102.08 128.67 48.45 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.622 1.569 . . . . 0.0 110.45 168.286 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -106.49 113.11 26.43 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 127.039 2.136 . . . . 0.0 108.071 176.11 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 52.9 m -121.88 132.42 54.56 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 114.817 1.414 . . . . 0.0 114.817 -167.763 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 21.9 t -102.04 104.43 16.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 167.469 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 88.1 t -69.59 126.99 30.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 123.725 0.81 . . . . 0.0 109.858 179.124 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 47.17 59.28 4.15 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.878 1.671 . . . . 0.0 112.327 177.854 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -59.92 137.7 58.01 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.049 1.34 . . . . 0.0 112.737 -170.018 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 36.5 mtp180 -100.01 158.49 15.79 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.914 1.685 . . . . 0.0 109.889 -176.91 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 20.1 mtp180 -58.92 -29.08 66.82 Favored 'General case' 0 N--CA 1.484 1.236 0 O-C-N 120.846 -1.159 . . . . 0.0 112.576 176.039 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -51.23 -30.53 17.72 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.534 1.934 . . . . 0.0 113.948 168.559 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 47.4 m-20 -90.3 -8.89 49.74 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.893 1.277 . . . . 0.0 113.119 -169.693 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 50.4 m -62.98 138.88 58.69 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.058 -1.026 . . . . 0.0 112.202 177.302 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 149.72 -170.15 29.87 Favored Glycine 0 N--CA 1.472 1.095 0 C-N-CA 124.669 1.128 . . . . 0.0 113.0 -177.029 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.6 m -89.34 140.98 28.96 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.136 0.974 . . . . 0.0 110.698 -177.517 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -132.15 160.98 34.46 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.949 2.1 . . . . 0.0 110.478 176.702 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -156.64 161.57 39.89 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.676 1.19 . . . . 0.0 112.33 175.496 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 23.6 t -113.81 151.36 32.17 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.685 1.594 . . . . 0.0 111.093 -178.006 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -152.57 136.8 5.56 Favored Glycine 0 N--CA 1.473 1.165 0 C-N-CA 124.082 0.848 . . . . 0.0 113.688 -179.529 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -111.33 153.81 25.44 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 118.352 1.076 . . . . 0.0 112.659 -179.22 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.8 tt -141.19 132.56 28.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.664 1.186 . . . . 0.0 110.44 170.414 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 29.6 t -65.22 161.57 19.04 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.805 1.242 . . . . 0.0 113.85 -175.216 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 3.1 pp -64.38 -12.65 44.83 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.445 1.498 . . . . 0.0 114.971 176.654 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -78.42 141.11 60.88 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 124.401 1.081 . . . . 0.0 112.398 -178.514 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_exo -56.59 -28.78 76.26 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.409 2.739 . . . . 0.0 114.319 173.203 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -81.92 -1.52 48.17 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.259 1.424 . . . . 0.0 113.861 -178.947 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.03 164.65 12.42 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 114.387 1.254 . . . . 0.0 114.387 -174.478 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -145.03 154.78 42.88 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.419 1.888 . . . . 0.0 108.81 176.466 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 55.8 mt -72.86 121.63 23.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 123.62 0.768 . . . . 0.0 111.328 -173.887 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -92.72 123.61 36.12 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.084 1.754 . . . . 0.0 108.944 169.071 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -87.31 145.2 26.44 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.818 0.847 . . . . 0.0 111.96 -179.005 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 5.2 t -92.77 -165.45 1.34 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.055 1.342 . . . . 0.0 112.002 170.065 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 87.3 mt -68.2 158.94 32.13 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.015 1.326 . . . . 0.0 111.206 169.895 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.29 147.46 31.42 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.76 1.224 . . . . 0.0 111.209 170.14 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -144.3 155.77 43.97 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.588 1.555 . . . . 0.0 111.342 -177.734 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -102.87 141.39 35.75 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 178.582 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 54.7 tp -99.6 131.75 45.39 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 126.836 2.054 . . . . 0.0 108.662 168.956 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 28.7 ttm180 -127.28 110.84 13.25 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.703 1.601 . . . . 0.0 109.429 -179.989 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 42.6 t -101.37 116.47 45.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 124.501 1.12 . . . . 0.0 108.84 177.519 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 72.8 p -98.1 147.79 24.2 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.628 1.571 . . . . 0.0 110.652 -178.635 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -59.53 139.81 56.82 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.267 0.627 . . . . 0.0 111.76 -177.824 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 79.1 ttt-85 -76.8 107.16 8.92 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.794 0.837 . . . . 0.0 110.311 -178.397 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -78.6 163.03 25.84 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.978 1.311 . . . . 0.0 112.861 -179.002 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -69.93 154.35 42.07 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.401 1.08 . . . . 0.0 112.541 175.151 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 . . . . . 0 C--O 1.254 1.29 0 C-N-CA 125.186 1.394 . . . . 0.0 112.923 177.337 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 57.9 ttm . . . . . 0 N--CA 1.49 1.539 0 CA-C-O 118.437 -0.792 . . . . 0.0 110.292 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -61.41 -41.53 40.41 Favored 'Trans proline' 0 CA--C 1.544 0.995 0 C-N-CA 123.37 2.714 . . . . 0.0 115.824 -177.696 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -61.32 123.8 13.51 Favored 'Trans proline' 0 C--N 1.356 0.964 0 C-N-CA 122.625 2.217 . . . . 0.0 112.369 178.219 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.7 t -167.74 156.79 9.71 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.394 1.477 . . . . 0.0 111.576 -178.541 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -161.85 111.99 1.59 Allowed 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 126.034 1.734 . . . . 0.0 109.873 177.584 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 90.0 p -141.03 161.55 53.06 Favored Pre-proline 0 CA--C 1.549 0.918 0 C-N-CA 124.618 1.167 . . . . 0.0 114.097 -174.643 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -75.71 162.83 91.61 Favored 'Cis proline' 0 C--N 1.352 0.746 0 CA-C-N 118.952 0.662 . . . . 0.0 111.456 -10.073 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.69 -25.88 67.52 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 171.868 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 40.4 tp -140.51 118.83 12.1 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 125.907 1.683 . . . . 0.0 109.012 170.688 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 50.6 tp -103.56 129.64 50.83 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.817 1.247 . . . . 0.0 109.127 169.971 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 14.0 p -112.78 128.99 69.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 123.931 0.892 . . . . 0.0 110.271 170.05 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 27.5 m -128.47 166.43 25.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 125.47 1.508 . . . . 0.0 111.865 172.911 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.6 m -90.98 148.43 22.42 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.828 1.251 . . . . 0.0 110.38 173.511 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -54.24 122.03 9.45 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.395 1.478 . . . . 0.0 111.533 176.906 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.73 -1.44 78.47 Favored Glycine 0 CA--C 1.535 1.303 0 C-N-CA 125.585 1.564 . . . . 0.0 114.897 -176.972 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -88.94 159.41 17.66 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.439 1.62 . . . . 0.0 111.381 171.748 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -87.84 135.06 33.55 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.533 -0.729 . . . . 0.0 111.474 171.476 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -108.02 129.91 55.1 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.909 1.683 . . . . 0.0 110.534 179.346 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 39.5 m -132.88 130.22 39.42 Favored 'General case' 0 N--CA 1.476 0.866 0 CA-C-N 119.256 0.935 . . . . 0.0 112.032 178.908 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -102.03 157.66 16.71 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.798 2.039 . . . . 0.0 110.894 172.259 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 46.8 m -113.02 139.75 48.41 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 125.994 1.718 . . . . 0.0 110.058 178.571 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 53.6 t -150.34 149.36 29.98 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.068 1.347 . . . . 0.0 113.08 -177.608 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 8.1 t -154.1 161.76 41.67 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.597 1.159 . . . . 0.0 112.56 169.38 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -142.1 156.31 45.38 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.946 2.098 . . . . 0.0 112.228 -178.314 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 45.6 m -83.35 108.44 16.54 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 106.165 -1.791 . . . . 0.0 106.165 166.267 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 34.2 m120 -78.9 87.11 4.75 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-O 121.689 0.757 . . . . 0.0 112.049 -168.941 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 17.6 p -77.71 -15.49 59.11 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.772 2.029 . . . . 0.0 113.426 175.714 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 63.2 m -83.5 132.53 34.94 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.804 1.242 . . . . 0.0 110.284 170.31 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.4 tm-20 -62.45 -34.53 76.98 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.644 1.177 . . . . 0.0 111.923 179.367 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 9.9 t -152.23 149.74 29.05 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 125.747 1.619 . . . . 0.0 109.12 169.286 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 54.6 p90 -159.53 163.4 35.22 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 -167.586 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.1 t -106.87 136.57 41.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 126.1 1.76 . . . . 0.0 106.917 167.689 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.6 tt -109.64 134.94 51.36 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.509 0.723 . . . . 0.0 109.777 174.845 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.442 HD21 HG22 ' A' ' 126' ' ' ILE . 2.4 m-80 -133.35 160.92 35.92 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -166.14 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 67.2 t-105 -115.54 131.65 56.87 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 126.532 1.933 . . . . 0.0 110.877 169.593 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -122.53 156.29 34.48 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.052 1.341 . . . . 0.0 111.956 179.298 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 43.6 ttt-85 -112.84 142.84 45.03 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 126.06 1.744 . . . . 0.0 109.871 169.451 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 67.2 mmm -75.78 142.52 42.3 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.84 0.856 . . . . 0.0 112.384 173.843 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.7 p -90.76 163.61 29.41 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 124.585 1.154 . . . . 0.0 111.101 168.698 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -69.66 -11.09 30.23 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 122.903 2.402 . . . . 0.0 113.086 173.204 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.0 t -94.78 8.09 43.74 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.879 1.272 . . . . 0.0 112.401 172.883 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 64.2 t30 68.84 21.89 7.46 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.744 2.018 . . . . 0.0 113.096 -178.635 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -93.19 -175.05 3.72 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.286 1.034 . . . . 0.0 109.502 169.382 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 11.9 p -138.94 150.41 45.88 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.278 1.031 . . . . 0.0 112.004 -172.859 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -133.96 133.8 41.79 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.081 0.953 . . . . 0.0 111.816 173.403 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -77.3 127.91 33.41 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.735 0.814 . . . . 0.0 111.502 -178.019 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 18.9 mt -106.56 -32.07 8.22 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.901 0.881 . . . . 0.0 113.296 178.65 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -154.57 161.45 41.61 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.303 1.441 . . . . 0.0 111.87 -177.056 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.57 166.31 31.05 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.503 1.121 . . . . 0.0 113.23 -179.133 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -144.24 114.28 5.31 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 126.544 1.937 . . . . 0.0 109.597 174.619 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo -57.52 155.08 32.33 Favored 'Cis proline' 0 CA--C 1.538 0.707 0 CA-C-N 119.546 0.874 . . . . 0.0 112.761 -11.128 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -73.62 128.88 36.72 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.465 0.65 . . . . 0.0 112.536 178.951 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 23.1 p-10 -100.83 8.77 43.01 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 126.668 1.987 . . . . 0.0 112.754 169.723 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 50.3 mtm180 -73.54 14.38 0.36 Allowed 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.112 2.165 . . . . 0.0 115.867 -169.729 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 21.8 t -65.49 -28.26 69.07 Favored 'General case' 0 CA--C 1.548 0.869 0 O-C-N 121.096 -1.002 . . . . 0.0 111.79 169.168 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 62.3 mm-40 -75.44 142.56 74.75 Favored Pre-proline 0 CA--C 1.549 0.93 0 O-C-N 121.134 -0.979 . . . . 0.0 111.039 171.84 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -56.91 158.09 18.2 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 124.471 3.448 . . . . 0.0 115.257 -179.162 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 101.78 19.25 15.82 Favored Glycine 0 CA--C 1.532 1.133 0 C-N-CA 125.164 1.364 . . . . 0.0 113.811 177.753 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.8 pm0 -93.17 160.26 14.92 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.473 1.509 . . . . 0.0 113.343 -176.066 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -142.86 108.74 5.16 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.303 1.441 . . . . 0.0 109.475 168.999 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 17.1 m -62.02 -13.54 26.93 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.378 1.471 . . . . 0.0 114.437 -174.452 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 36.3 mtp-105 -63.37 -29.29 70.62 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 125.07 1.348 . . . . 0.0 112.682 172.574 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -85.21 139.32 31.75 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.444 1.098 . . . . 0.0 109.808 171.935 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 83.2 mtm180 -144.44 149.36 35.9 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.25 1.42 . . . . 0.0 111.605 -173.568 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 77.8 t -126.54 130.93 71.76 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 125.377 1.471 . . . . 0.0 108.409 168.988 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 58.7 m -128.82 138.76 52.24 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.871 1.268 . . . . 0.0 110.59 -174.85 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 27.0 tt0 -97.86 136.62 37.9 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.689 1.195 . . . . 0.0 110.215 170.898 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -97.36 159.87 30.19 Favored Pre-proline 0 CA--C 1.546 0.812 0 C-N-CA 125.427 1.491 . . . . 0.0 111.489 -170.431 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -66.68 -11.1 30.5 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 123.593 2.862 . . . . 0.0 114.056 -178.405 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 22.2 m120 -66.29 -19.33 65.79 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 119.087 0.858 . . . . 0.0 113.052 170.548 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 91.16 -33.87 4.53 Favored Glycine 0 N--CA 1.474 1.229 0 C-N-CA 126.391 1.948 . . . . 0.0 114.377 169.934 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 95.4 mtm-85 -129.06 73.72 1.53 Allowed 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.718 1.607 . . . . 0.0 108.659 169.594 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -170.15 141.6 2.13 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 127.341 2.257 . . . . 0.0 109.278 -178.787 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -145.46 150.36 36.34 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.624 0.726 . . . . 0.0 112.613 -169.725 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -118.98 149.49 41.53 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.421 1.488 . . . . 0.0 111.373 171.321 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.5 mpt? -128.4 124.93 37.54 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.191 0.996 . . . . 0.0 109.358 171.37 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.1 t -124.6 148.29 47.96 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -168.817 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 17.0 t -125.09 105.94 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 127.128 2.171 . . . . 0.0 107.817 176.001 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 96.1 t -80.06 131.43 34.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 124.362 1.065 . . . . 0.0 111.152 -174.997 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 48.8 ttt85 53.4 61.3 3.2 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.917 1.687 . . . . 0.0 111.278 176.002 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.4 129.31 39.56 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.426 1.091 . . . . 0.0 110.844 -172.964 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 12.7 mmt-85 -100.6 167.99 9.99 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.765 1.626 . . . . 0.0 109.511 174.464 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 90.9 mtm-85 -55.56 -34.47 64.78 Favored 'General case' 0 N--CA 1.479 1.015 0 O-C-N 120.922 -1.111 . . . . 0.0 113.009 -178.877 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 34.5 t30 -62.1 -23.79 66.74 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.395 1.478 . . . . 0.0 114.514 174.87 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -80.36 -5.72 56.86 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.087 0.955 . . . . 0.0 112.82 176.258 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 24.4 m -65.49 136.43 56.42 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 120.405 -1.434 . . . . 0.0 110.99 169.943 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 160.07 -165.44 34.76 Favored Glycine 0 N--CA 1.467 0.732 0 O-C-N 121.558 -0.714 . . . . 0.0 113.241 -177.267 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.1 m -107.87 132.22 53.68 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.088 0.955 . . . . 0.0 110.338 -175.933 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -140.71 168.11 20.58 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.661 1.585 . . . . 0.0 111.759 -174.123 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -159.99 151.02 19.25 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 115.013 1.486 . . . . 0.0 115.013 -177.034 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 46.4 t -88.77 136.96 32.73 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.964 2.106 . . . . 0.0 111.275 173.814 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -159.02 135.19 4.08 Favored Glycine 0 N--CA 1.475 1.249 0 N-CA-C 115.402 0.921 . . . . 0.0 115.402 174.859 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -99.0 159.21 15.12 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.34 1.456 . . . . 0.0 112.501 176.393 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.442 HG22 HD21 ' A' ' 66' ' ' ASN . 19.0 tt -150.97 134.78 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 125.245 1.418 . . . . 0.0 110.749 178.539 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 41.7 t -64.69 159.66 21.65 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.057 0.943 . . . . 0.0 113.105 177.279 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 44.1 mt -75.51 -12.15 60.17 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.298 0.851 . . . . 0.0 113.298 172.324 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -65.14 147.01 98.84 Favored Pre-proline 0 CA--C 1.552 1.03 0 C-N-CA 124.036 0.934 . . . . 0.0 112.775 -179.432 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -56.5 -30.32 81.91 Favored 'Trans proline' 0 C--N 1.354 0.836 0 C-N-CA 123.511 2.807 . . . . 0.0 114.208 174.142 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 60.2 mtpt -88.35 5.98 39.43 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.193 1.397 . . . . 0.0 113.975 -178.197 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -61.18 153.31 26.33 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 -173.617 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -137.06 159.05 43.04 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.396 1.878 . . . . 0.0 108.744 174.365 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 45.2 mt -78.82 123.7 36.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 O-C-N 121.72 -0.613 . . . . 0.0 110.572 -175.939 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -97.03 104.06 16.04 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 126.106 1.762 . . . . 0.0 108.251 169.065 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -123.06 158.81 29.78 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.994 1.318 . . . . 0.0 113.868 -169.056 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 53.3 m -97.92 159.08 15.16 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.373 1.069 . . . . 0.0 112.14 171.748 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 10.6 mp -63.7 130.39 44.03 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.951 0.9 . . . . 0.0 110.953 -177.674 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.21 145.69 36.4 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.85 1.426 . . . . 0.0 114.85 -170.046 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -125.91 162.89 24.16 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.739 2.015 . . . . 0.0 112.067 -176.259 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -106.31 141.48 37.57 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.938 1.295 . . . . 0.0 112.375 -172.406 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 52.5 tp -115.41 131.58 56.89 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 126.332 1.853 . . . . 0.0 109.114 169.656 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 62.3 ttm-85 -124.07 123.48 40.42 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.794 1.638 . . . . 0.0 110.367 177.638 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 40.0 t -107.8 114.02 45.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 125.037 1.335 . . . . 0.0 109.272 172.676 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 73.0 p -95.11 152.2 18.55 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.509 1.524 . . . . 0.0 110.705 178.142 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -60.02 144.54 49.08 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.617 0.767 . . . . 0.0 112.679 -176.698 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 31.7 tpt85 -74.99 109.25 8.3 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 124.269 1.028 . . . . 0.0 109.239 175.624 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 84.0 mtp180 -74.34 160.45 31.04 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.684 0.794 . . . . 0.0 110.216 172.948 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -67.81 119.66 12.87 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.474 0.71 . . . . 0.0 111.497 178.767 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 . . . . . 0 C--O 1.251 1.17 0 C-N-CA 127.414 2.286 . . . . 0.0 111.178 -176.837 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.488 1.474 0 CA-C-O 115.972 -1.965 . . . . 0.0 113.459 . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -55.7 141.14 84.66 Favored 'Trans proline' 0 C--N 1.359 1.111 0 CA-C-N 123.223 2.187 . . . . 0.0 112.817 -174.915 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.2 117.17 4.88 Favored 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 122.982 2.455 . . . . 0.0 111.993 -170.919 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.9 t -179.09 159.28 0.97 Allowed 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 127.216 2.206 . . . . 0.0 111.211 -178.162 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -125.03 133.64 52.87 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.803 1.641 . . . . 0.0 110.121 -178.538 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 93.6 p -140.96 155.19 68.95 Favored Pre-proline 0 CA--C 1.551 0.981 0 N-CA-C 114.511 1.3 . . . . 0.0 114.511 -176.756 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -68.96 162.03 82.66 Favored 'Cis proline' 0 C--N 1.353 0.766 0 CA-C-N 119.101 0.715 . . . . 0.0 111.511 -7.422 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.33 -32.61 70.24 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 122.803 0.441 . . . . 0.0 112.169 173.119 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 50.1 tp -140.23 120.41 13.81 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 125.452 1.501 . . . . 0.0 109.294 171.175 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 55.8 tp -100.6 125.89 47.02 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.439 1.496 . . . . 0.0 109.003 170.104 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.8 t -108.82 125.64 65.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 171.203 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 27.7 m -128.69 163.4 33.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 124.775 1.23 . . . . 0.0 110.83 173.014 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 52.7 m -88.21 146.95 25.1 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.592 0.757 . . . . 0.0 110.097 169.911 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -54.36 123.04 11.73 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.289 1.436 . . . . 0.0 111.074 174.822 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.08 3.52 72.97 Favored Glycine 0 CA--C 1.532 1.111 0 C-N-CA 125.863 1.697 . . . . 0.0 114.9 -174.733 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -90.26 157.02 17.88 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 119.612 1.706 . . . . 0.0 111.376 169.214 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -85.49 119.77 26.21 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.763 0.825 . . . . 0.0 109.957 174.628 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -98.84 129.62 45.23 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.466 1.107 . . . . 0.0 110.752 -179.246 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 89.9 m -132.73 131.46 41.24 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 119.352 0.978 . . . . 0.0 111.692 177.392 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -102.93 155.93 18.02 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.381 1.873 . . . . 0.0 111.089 172.52 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.6 m -98.68 136.03 39.32 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 125.402 1.481 . . . . 0.0 107.887 168.874 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 35.7 t -138.1 124.68 20.83 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 124.639 1.176 . . . . 0.0 110.308 -179.704 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 75.6 m -116.14 143.89 44.88 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 124.228 1.011 . . . . 0.0 111.094 -173.219 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -141.23 152.98 45.02 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 125.185 1.394 . . . . 0.0 113.694 170.026 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.1 t -132.83 143.37 49.49 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 166.435 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -146.85 145.36 29.83 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.528 0.731 . . . . 0.0 112.43 -168.208 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 24.4 p -86.84 -16.96 34.56 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.475 1.51 . . . . 0.0 113.529 -177.279 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 74.6 m -88.43 160.3 17.61 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.54 1.136 . . . . 0.0 111.629 173.5 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -69.91 -16.13 63.18 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.027 1.331 . . . . 0.0 114.107 -177.155 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.5 t -161.73 157.54 24.5 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.466 1.507 . . . . 0.0 111.027 177.597 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 53.9 p90 -155.83 153.6 30.02 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.126 1.37 . . . . 0.0 111.946 -177.299 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.6 t -95.98 128.24 47.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 171.466 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -112.77 118.67 35.61 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 125.379 1.471 . . . . 0.0 108.687 -177.123 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -116.48 155.24 28.96 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.921 1.688 . . . . 0.0 111.636 -169.438 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 13.6 t90 -124.32 138.57 54.37 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.726 1.211 . . . . 0.0 112.29 179.941 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 53.7 m-85 -136.65 145.61 45.01 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.031 1.333 . . . . 0.0 113.528 -174.973 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 78.9 ttt-85 -106.42 142.0 36.8 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.683 1.593 . . . . 0.0 108.414 167.833 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 37.1 mtp -86.73 145.37 26.69 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 119.034 0.833 . . . . 0.0 112.624 177.864 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.6 m -92.41 159.13 37.57 Favored Pre-proline 0 CA--C 1.547 0.86 0 C-N-CA 125.056 1.342 . . . . 0.0 111.999 175.755 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -57.79 -25.73 70.23 Favored 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 124.102 3.201 . . . . 0.0 114.224 174.412 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 33.5 p -77.06 -0.56 25.11 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.474 1.91 . . . . 0.0 114.017 174.943 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 71.16 20.87 4.99 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 127.178 2.191 . . . . 0.0 112.442 -173.111 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 20.5 mm100 -88.3 -172.67 3.88 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.033 0.933 . . . . 0.0 110.083 168.99 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.7 p -141.35 150.1 42.0 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.761 1.624 . . . . 0.0 110.628 -175.817 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -128.15 132.26 48.91 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.786 1.234 . . . . 0.0 111.032 176.909 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 57.0 tttt -79.76 132.47 36.17 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.372 0.669 . . . . 0.0 111.644 -176.639 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 67.9 mt -106.88 -46.09 4.03 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.077 1.351 . . . . 0.0 112.487 -169.921 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -174.15 175.95 2.61 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 127.175 2.19 . . . . 0.0 110.089 -174.478 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.63 167.7 27.83 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.888 1.275 . . . . 0.0 112.318 -179.363 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.461 ' CG ' ' HA ' ' A' ' 83' ' ' PRO . 54.7 t80 -129.33 144.0 51.06 Favored Pre-proline 0 CA--C 1.549 0.909 0 C-N-CA 126.181 1.792 . . . . 0.0 110.226 169.808 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.461 ' HA ' ' CG ' ' A' ' 82' ' ' PHE . 68.4 Cg_exo -58.03 -42.06 0.32 Allowed 'Cis proline' 0 C--N 1.356 0.969 0 N-CA-C 116.352 1.635 . . . . 0.0 116.352 2.755 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -145.43 152.94 40.61 Favored 'General case' 0 C--N 1.313 -0.998 0 C-N-CA 129.097 2.959 . . . . 0.0 113.048 177.292 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -96.11 4.81 52.24 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.488 1.515 . . . . 0.0 114.249 175.916 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 77.3 mtp85 -61.19 -11.13 8.03 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 115.66 1.726 . . . . 0.0 115.66 -169.388 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 47.2 p -71.67 -20.37 61.95 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.641 1.176 . . . . 0.0 113.918 172.297 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -135.82 168.55 16.84 Favored Pre-proline 0 CA--C 1.548 0.9 0 C-N-CA 125.761 1.625 . . . . 0.0 111.542 -176.498 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -59.55 138.48 83.96 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 123.264 2.642 . . . . 0.0 111.889 169.626 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -97.35 -27.0 9.56 Favored Glycine 0 N--CA 1.471 1.015 0 C-N-CA 124.914 1.245 . . . . 0.0 111.762 177.606 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 70.11 -40.62 0.47 Allowed 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 129.812 3.245 . . . . 0.0 116.069 167.5 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -142.95 131.13 21.93 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.427 1.891 . . . . 0.0 111.021 176.868 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 14.7 m -71.96 -3.84 24.99 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.433 1.093 . . . . 0.0 113.607 176.662 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 46.5 mtp85 -66.78 -28.09 68.11 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.649 1.579 . . . . 0.0 113.703 -175.572 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 -101.43 142.32 32.99 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.139 1.775 . . . . 0.0 112.013 -172.673 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 65.3 ttt180 -143.48 144.36 31.96 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.63 1.572 . . . . 0.0 111.27 178.475 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 57.6 t -120.34 132.56 69.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 125.663 1.585 . . . . 0.0 109.08 169.707 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 25.0 m -126.66 133.79 50.89 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.922 1.289 . . . . 0.0 109.858 177.11 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -84.86 138.38 32.58 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.398 0.679 . . . . 0.0 110.67 172.481 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 41.5 mt -85.07 159.61 56.65 Favored Pre-proline 0 CA--C 1.544 0.717 0 C-N-CA 124.863 1.265 . . . . 0.0 111.771 179.247 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -63.03 -5.91 8.61 Favored 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 123.675 2.917 . . . . 0.0 113.95 174.012 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 23.2 m120 -60.93 -25.22 66.62 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.191 0.996 . . . . 0.0 112.852 169.251 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 89.23 -16.51 55.67 Favored Glycine 0 N--CA 1.476 1.308 0 C-N-CA 125.53 1.538 . . . . 0.0 114.768 174.427 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.6 ptp180 -154.57 73.69 0.91 Allowed 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 126.198 1.799 . . . . 0.0 109.487 169.816 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -173.73 148.67 1.5 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 128.378 2.671 . . . . 0.0 108.55 -178.642 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -146.66 153.48 40.35 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.796 1.035 . . . . 0.0 113.796 -166.844 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -116.33 141.75 47.75 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.887 1.675 . . . . 0.0 110.065 168.115 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 42.5 mtt -130.73 115.29 16.45 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 124.629 1.172 . . . . 0.0 110.546 -173.924 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 43.7 m -116.02 134.03 55.39 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.36 1.245 . . . . 0.0 114.36 -167.749 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 17.1 t -104.56 113.72 42.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 126.569 1.948 . . . . 0.0 106.825 167.865 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 4.0 p -77.48 133.61 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 122.513 0.325 . . . . 0.0 110.755 -179.911 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 45.92 64.11 1.59 Allowed 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 125.491 1.516 . . . . 0.0 112.08 174.12 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.02 144.41 57.3 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.368 1.067 . . . . 0.0 112.994 -169.694 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 54.3 mtp85 -114.87 158.33 22.1 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 126.598 1.959 . . . . 0.0 110.036 -176.393 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 91.0 mtm-85 -53.6 -32.62 51.87 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 -178.833 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -70.84 -18.82 62.7 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 115.676 1.732 . . . . 0.0 115.676 176.613 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -73.2 -25.55 60.81 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 119.566 1.076 . . . . 0.0 112.045 178.769 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 14.8 m -51.35 139.44 19.32 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.979 1.312 . . . . 0.0 112.905 178.923 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 152.09 -166.6 31.04 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 124.338 0.971 . . . . 0.0 113.023 -175.777 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.5 m -92.36 143.88 25.94 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.9 1.28 . . . . 0.0 110.167 -179.617 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -138.39 156.55 47.49 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.931 1.692 . . . . 0.0 111.719 -177.606 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -163.06 157.09 20.34 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.06 1.344 . . . . 0.0 112.4 177.527 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 5.6 m -100.51 162.98 12.57 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.997 0.919 . . . . 0.0 111.85 172.724 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -145.21 130.19 3.76 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 124.392 0.996 . . . . 0.0 112.163 169.437 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -111.65 145.0 40.0 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 118.41 1.105 . . . . 0.0 112.327 178.437 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.4 tt -141.34 133.58 29.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.236 1.414 . . . . 0.0 110.125 179.405 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 53.2 p -71.48 161.62 30.74 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 -176.594 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -58.44 -15.49 11.09 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 115.372 1.619 . . . . 0.0 115.372 177.399 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -70.56 136.6 85.96 Favored Pre-proline 0 CA--C 1.552 1.027 0 C-N-CA 125.047 1.339 . . . . 0.0 112.244 -178.359 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_exo -57.07 -27.89 76.12 Favored 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 123.426 2.751 . . . . 0.0 114.066 172.631 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 14.5 tppt? -84.4 1.73 43.94 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 125.395 1.478 . . . . 0.0 113.997 -177.916 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -67.11 161.41 24.64 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -172.959 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 28.0 mp0 -128.09 159.15 35.99 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.794 2.037 . . . . 0.0 108.983 170.72 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 42.4 mt -82.83 120.44 34.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 123.509 0.723 . . . . 0.0 110.597 178.868 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 15.3 ptpt -90.99 143.76 26.38 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.421 1.089 . . . . 0.0 111.241 168.648 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -140.07 158.79 43.5 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 126.255 1.822 . . . . 0.0 110.351 -173.222 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 6.2 t -136.74 -166.67 1.94 Allowed 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.269 1.028 . . . . 0.0 112.871 -179.985 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 96.4 mt -62.7 124.77 21.86 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.268 1.827 . . . . 0.0 112.423 -170.371 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 73.6 mtm-85 -62.23 151.36 36.45 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.817 1.647 . . . . 0.0 113.507 -173.965 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.89 166.26 12.17 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.668 1.987 . . . . 0.0 110.846 173.33 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -133.85 146.24 50.42 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.422 1.089 . . . . 0.0 111.996 178.727 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 59.5 tp -113.86 137.11 52.12 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 126.182 1.793 . . . . 0.0 110.201 173.051 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 61.9 ttm-85 -127.81 120.18 27.28 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 125.522 1.529 . . . . 0.0 109.699 169.412 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 43.5 t -104.32 113.35 41.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 124.786 1.234 . . . . 0.0 108.742 173.144 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 53.8 p -95.05 140.88 29.38 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.349 1.459 . . . . 0.0 110.039 -178.697 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 4.2 pm0 -61.96 144.32 55.24 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.729 0.812 . . . . 0.0 112.855 -172.406 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 45.3 ttt85 -77.66 98.32 5.42 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.049 0.939 . . . . 0.0 110.837 -170.399 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.41 162.13 27.46 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.93 1.292 . . . . 0.0 113.117 -177.245 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -70.53 154.31 42.01 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.44 1.096 . . . . 0.0 112.419 175.22 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 . . . . . 0 C--O 1.253 1.276 0 C-N-CA 125.079 1.352 . . . . 0.0 113.274 177.682 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 47.5 ttp . . . . . 0 N--CA 1.488 1.472 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.233 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -72.02 168.53 23.73 Favored 'Trans proline' 0 CA--C 1.543 0.943 0 C-N-CA 123.339 2.693 . . . . 0.0 111.104 172.459 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -55.01 126.24 21.92 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.963 2.442 . . . . 0.0 111.745 172.11 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 86.7 m -140.91 148.63 40.75 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.252 1.021 . . . . 0.0 110.944 -169.809 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -114.11 124.32 51.8 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.97 2.108 . . . . 0.0 108.11 169.318 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 88.0 p -140.75 156.09 69.05 Favored Pre-proline 0 CA--C 1.549 0.916 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -169.156 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -66.68 161.18 75.84 Favored 'Cis proline' 0 C--N 1.355 0.894 0 CA-C-N 119.84 0.979 . . . . 0.0 112.111 -2.457 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.81 -27.5 66.65 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 177.75 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 49.1 tp -141.15 122.54 14.93 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.365 1.466 . . . . 0.0 108.749 169.835 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 59.5 tp -106.16 126.06 51.75 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.157 1.383 . . . . 0.0 109.057 170.869 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.3 t -109.68 124.43 66.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 123.864 0.866 . . . . 0.0 108.798 172.998 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 33.7 m -128.66 172.43 15.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 C-N-CA 124.919 1.287 . . . . 0.0 110.951 171.43 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 66.2 m -104.48 151.92 22.98 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.516 1.526 . . . . 0.0 110.313 170.971 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -44.29 124.63 4.12 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.313 1.445 . . . . 0.0 112.967 172.357 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 89.99 -2.37 81.68 Favored Glycine 0 CA--C 1.531 1.048 0 C-N-CA 125.732 1.634 . . . . 0.0 114.484 -179.261 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -89.31 153.82 20.58 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.699 1.75 . . . . 0.0 111.909 174.367 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -80.81 118.25 22.17 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.588 0.755 . . . . 0.0 110.355 174.806 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -97.32 114.26 26.02 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.074 0.95 . . . . 0.0 110.533 178.978 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 46.9 m -122.35 124.19 43.13 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.936 0.895 . . . . 0.0 111.4 -175.288 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -102.45 158.16 16.41 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 126.646 1.978 . . . . 0.0 110.742 171.683 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 86.1 m -101.63 135.05 43.8 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.13 1.372 . . . . 0.0 109.551 169.861 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 42.7 t -113.7 132.79 55.67 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.611 1.564 . . . . 0.0 110.691 169.631 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 67.3 m -126.55 122.13 34.24 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.948 0.899 . . . . 0.0 110.852 179.574 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 24.8 m-85 -134.26 156.13 48.96 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 126.701 2.0 . . . . 0.0 110.682 169.515 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 64.1 p -133.92 143.23 48.1 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.665 1.186 . . . . 0.0 110.594 169.336 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -147.07 144.08 28.82 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.058 1.343 . . . . 0.0 111.21 -176.779 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 23.1 p -70.93 -26.28 63.13 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.378 1.471 . . . . 0.0 112.281 172.048 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 11.3 m -53.06 138.89 29.74 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 126.841 2.056 . . . . 0.0 111.93 170.016 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -63.12 -31.21 72.3 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.658 1.183 . . . . 0.0 112.034 178.409 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.6 m -157.73 159.79 37.21 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 126.201 1.8 . . . . 0.0 110.921 175.003 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 52.1 p90 -160.06 162.22 34.11 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.731 1.612 . . . . 0.0 110.774 -173.409 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 58.2 t -95.94 129.35 46.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 C-N-CA 124.503 1.121 . . . . 0.0 108.24 175.29 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 19.4 tp -107.59 139.72 41.7 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.417 1.087 . . . . 0.0 109.923 172.592 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 13.6 m-80 -132.78 149.84 52.23 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.524 1.529 . . . . 0.0 111.107 -168.997 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 18.3 t90 -121.73 137.89 54.58 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.035 1.334 . . . . 0.0 111.617 -179.055 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -137.43 145.33 43.03 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 -172.836 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -102.03 139.76 37.22 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.021 1.328 . . . . 0.0 108.274 167.01 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 32.8 mtp -84.26 142.75 30.02 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.107 0.867 . . . . 0.0 112.11 176.862 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 45.6 m -91.17 158.4 41.41 Favored Pre-proline 0 CA--C 1.548 0.883 0 C-N-CA 124.843 1.257 . . . . 0.0 111.68 174.867 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -55.43 -33.45 85.89 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 123.947 3.098 . . . . 0.0 114.346 177.245 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.3 m -76.99 6.31 6.52 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.904 1.282 . . . . 0.0 113.895 177.374 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 74.02 20.93 2.69 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 127.208 2.203 . . . . 0.0 112.895 -178.188 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 20.7 mm100 -88.63 -172.89 3.92 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.185 0.994 . . . . 0.0 110.258 169.658 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.6 p -145.48 142.69 29.47 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.663 1.585 . . . . 0.0 110.323 -174.805 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -119.93 130.55 54.85 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 124.578 1.151 . . . . 0.0 111.17 175.493 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -77.97 125.75 29.81 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.364 1.065 . . . . 0.0 111.089 -177.12 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 55.7 mt -99.81 -49.31 4.4 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 125.172 1.389 . . . . 0.0 111.278 -172.658 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -162.6 173.16 14.3 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.249 1.819 . . . . 0.0 110.479 -178.006 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.18 163.34 36.11 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.074 1.35 . . . . 0.0 111.733 -178.215 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -145.62 124.08 6.52 Favored Pre-proline 0 CA--C 1.546 0.825 0 C-N-CA 124.833 1.253 . . . . 0.0 110.676 172.229 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.39 158.43 19.09 Favored 'Cis proline' 0 CA--C 1.538 0.681 0 CA-C-N 119.48 0.85 . . . . 0.0 112.761 -12.949 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -75.53 94.77 3.2 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 121.845 0.831 . . . . 0.0 110.591 179.176 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -91.56 -3.55 56.34 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.006 1.722 . . . . 0.0 114.548 -174.042 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 57.2 mtp180 -73.8 -54.81 7.19 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.69 1.196 . . . . 0.0 113.22 -168.703 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 34.4 m 61.09 10.9 3.12 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 126.039 1.736 . . . . 0.0 114.124 -176.134 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -135.82 164.85 40.37 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 127.668 2.387 . . . . 0.0 110.262 -171.302 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -67.99 169.64 16.02 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 123.352 2.702 . . . . 0.0 112.119 174.094 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 113.88 -1.68 24.39 Favored Glycine 0 CA--C 1.535 1.298 0 C-N-CA 124.941 1.258 . . . . 0.0 114.064 -171.747 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -97.48 157.43 16.01 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.21 1.404 . . . . 0.0 109.975 168.649 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -141.6 153.6 44.89 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.454 1.501 . . . . 0.0 110.173 172.984 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 54.4 p -63.68 -15.92 59.65 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.197 0.999 . . . . 0.0 113.405 175.009 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 41.6 mmm-85 -71.43 -16.71 62.39 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.276 1.43 . . . . 0.0 113.091 173.786 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 -108.05 135.3 49.64 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.789 1.236 . . . . 0.0 111.046 177.82 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 49.7 ttp180 -138.11 136.95 37.23 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.679 1.591 . . . . 0.0 110.609 -176.242 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 87.3 t -126.43 130.25 71.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 C-N-CA 125.633 1.573 . . . . 0.0 109.157 175.579 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 87.1 m -130.58 130.34 43.92 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.117 1.367 . . . . 0.0 110.281 -176.363 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -82.87 133.97 35.11 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.16 0.984 . . . . 0.0 110.195 173.652 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 28.4 mt -86.63 160.33 50.67 Favored Pre-proline 0 CA--C 1.543 0.697 0 C-N-CA 123.587 0.755 . . . . 0.0 111.339 176.659 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -62.49 -8.23 12.44 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 123.374 2.716 . . . . 0.0 114.187 174.75 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -65.77 -22.34 66.57 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-N 119.207 0.912 . . . . 0.0 112.602 169.271 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 80.66 -34.33 2.3 Favored Glycine 0 N--CA 1.473 1.167 0 C-N-CA 128.232 2.825 . . . . 0.0 113.914 175.871 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? -122.62 73.64 1.14 Allowed 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.743 1.617 . . . . 0.0 108.663 168.191 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -177.64 140.82 0.27 Allowed 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 128.495 2.718 . . . . 0.0 108.432 176.651 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -143.64 153.26 42.33 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 -168.666 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 21.4 m170 -108.67 131.72 54.63 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.341 1.456 . . . . 0.0 110.845 168.556 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -113.95 120.25 40.03 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 126.612 1.965 . . . . 0.0 108.157 176.691 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.2 t -128.31 127.17 42.22 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -168.383 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 47.8 t -91.17 116.39 32.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 125.441 1.496 . . . . 0.0 107.08 169.117 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 61.0 t -83.96 120.26 34.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 124.637 1.175 . . . . 0.0 109.638 -175.784 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 52.15 65.73 1.42 Allowed 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.228 1.811 . . . . 0.0 111.567 179.167 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.66 147.59 51.65 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.717 1.207 . . . . 0.0 112.628 -171.507 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 54.7 mmm-85 -122.72 165.31 16.75 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.971 1.709 . . . . 0.0 110.578 178.475 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 34.9 mtp180 -55.11 -33.88 63.21 Favored 'General case' 0 N--CA 1.483 1.217 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 -173.15 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -62.12 -18.54 61.13 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 125.241 1.417 . . . . 0.0 114.637 175.28 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 -81.21 -12.65 59.11 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 119.582 1.083 . . . . 0.0 113.316 176.903 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 20.9 m -62.64 138.63 58.54 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 119.517 1.053 . . . . 0.0 112.438 -179.486 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 154.74 -166.93 32.53 Favored Glycine 0 N--CA 1.473 1.124 0 O-C-N 121.377 -0.827 . . . . 0.0 113.611 -177.033 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 6.4 m -93.9 144.35 25.52 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.334 1.054 . . . . 0.0 110.366 -178.844 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 68.9 m-85 -142.96 155.51 44.7 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.354 1.461 . . . . 0.0 111.681 -177.989 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.4 pp -153.5 173.43 15.71 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.37 1.068 . . . . 0.0 112.593 177.933 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 28.1 t -125.6 156.13 39.63 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.813 1.645 . . . . 0.0 110.316 -176.209 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -152.74 137.02 5.64 Favored Glycine 0 N--CA 1.47 0.931 0 O-C-N 121.197 -0.939 . . . . 0.0 114.677 -179.188 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -110.02 152.1 26.34 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.736 1.214 . . . . 0.0 112.721 -179.506 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.5 tt -152.13 135.44 7.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 125.55 1.54 . . . . 0.0 110.442 173.634 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 33.7 m -67.04 159.65 28.26 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.775 0.83 . . . . 0.0 112.91 179.452 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 2.3 pp -72.05 -7.93 51.68 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 115.406 1.632 . . . . 0.0 115.406 -176.861 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -80.8 148.59 65.46 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 124.71 1.204 . . . . 0.0 112.082 177.156 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -68.66 -19.79 41.37 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 123.245 2.63 . . . . 0.0 113.355 -179.924 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -77.37 -9.56 58.92 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.798 1.239 . . . . 0.0 113.665 177.12 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.86 162.85 20.77 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.004 1.322 . . . . 0.0 113.785 -175.765 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -138.21 154.72 49.1 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.011 1.724 . . . . 0.0 109.368 175.857 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 45.8 mt -79.27 126.66 39.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 123.345 0.658 . . . . 0.0 110.838 -175.687 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -102.6 129.09 49.06 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.223 1.409 . . . . 0.0 109.38 169.375 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -104.11 149.42 25.24 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.742 1.217 . . . . 0.0 111.842 -174.386 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 88.1 p -91.62 170.03 10.26 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.661 1.356 . . . . 0.0 114.661 178.81 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 87.8 mt -68.27 127.77 34.13 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.033 0.933 . . . . 0.0 109.471 168.809 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.1 166.88 20.47 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 115.236 1.569 . . . . 0.0 115.236 -169.602 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -126.35 168.78 13.69 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.842 2.057 . . . . 0.0 111.234 169.574 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -120.57 142.16 49.62 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.301 1.44 . . . . 0.0 110.89 173.007 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 51.4 tp -110.16 131.24 55.23 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 126.082 1.753 . . . . 0.0 109.791 171.852 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -121.78 117.66 27.11 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.674 1.59 . . . . 0.0 109.395 169.955 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 39.5 t -104.18 111.84 35.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 C-N-CA 124.225 1.01 . . . . 0.0 108.665 170.949 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 71.8 p -86.69 151.3 23.53 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 126.087 1.755 . . . . 0.0 110.28 179.564 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -63.09 149.29 45.52 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.811 0.844 . . . . 0.0 112.805 -175.142 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 56.8 ttp180 -59.92 117.1 4.64 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 124.517 1.127 . . . . 0.0 109.697 -174.21 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 77.7 mtm-85 -70.61 152.67 43.65 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 -168.096 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -70.09 154.24 42.17 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.546 1.139 . . . . 0.0 112.447 175.053 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 . . . . . 0 C--O 1.254 1.293 0 C-N-CA 125.011 1.324 . . . . 0.0 114.451 176.921 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 75.0 mtm . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 116.506 -1.712 . . . . 0.0 111.875 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -71.19 160.92 47.54 Favored 'Trans proline' 0 CA--C 1.545 1.048 0 C-N-CA 122.438 2.092 . . . . 0.0 111.665 176.243 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -69.39 133.6 26.64 Favored 'Trans proline' 0 CA--C 1.537 0.655 0 C-N-CA 123.375 2.717 . . . . 0.0 111.322 176.276 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 37.3 p -153.11 151.61 30.37 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 125.436 1.494 . . . . 0.0 111.916 -172.452 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -121.93 134.39 54.84 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.382 1.473 . . . . 0.0 109.912 173.936 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.9 m -140.85 156.39 68.73 Favored Pre-proline 0 N--CA 1.479 1.016 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 179.523 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -70.17 158.16 92.51 Favored 'Cis proline' 0 C--N 1.352 0.733 0 CA-C-N 119.494 0.855 . . . . 0.0 110.926 -8.646 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -56.96 -32.01 65.6 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 172.715 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 49.2 tp -139.13 121.17 15.66 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.351 1.46 . . . . 0.0 109.322 170.031 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 49.4 tp -102.19 126.93 49.3 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.351 1.46 . . . . 0.0 109.205 171.019 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.6 t -110.75 124.64 67.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 124.081 0.952 . . . . 0.0 108.454 172.011 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 36.0 m -127.52 168.83 19.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 124.618 1.167 . . . . 0.0 111.677 174.174 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 44.0 m -94.54 146.41 24.12 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.869 1.267 . . . . 0.0 110.151 170.915 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -57.13 117.65 4.24 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.474 1.51 . . . . 0.0 111.867 -178.973 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 100.26 -2.9 56.53 Favored Glycine 0 CA--C 1.534 1.268 0 C-N-CA 125.919 1.723 . . . . 0.0 114.58 -175.937 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -86.21 157.27 20.01 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.232 1.516 . . . . 0.0 112.286 173.988 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -83.25 113.48 20.71 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.006 0.923 . . . . 0.0 110.44 175.773 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -95.82 116.63 29.19 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.101 0.961 . . . . 0.0 110.837 -178.754 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 36.1 m -121.5 127.49 51.09 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.763 0.825 . . . . 0.0 111.558 -177.014 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -100.66 150.42 22.75 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.07 1.748 . . . . 0.0 110.896 170.625 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 27.3 m -93.15 137.88 32.08 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 125.917 1.687 . . . . 0.0 108.179 169.337 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 42.9 t -143.88 131.19 20.85 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.9 1.28 . . . . 0.0 110.37 -176.356 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.9 t -128.27 136.09 50.54 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 121.321 -0.862 . . . . 0.0 112.058 -169.663 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -145.48 156.21 43.58 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.786 1.634 . . . . 0.0 113.464 174.504 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.2 t -148.42 139.06 22.83 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.898 1.679 . . . . 0.0 108.348 168.184 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -141.03 147.53 38.79 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.277 1.031 . . . . 0.0 112.314 -171.988 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 7.7 p -79.0 68.59 4.98 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 126.868 2.067 . . . . 0.0 110.697 176.424 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.1 t -156.87 165.07 37.24 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.319 1.448 . . . . 0.0 111.618 -173.211 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -74.6 -20.91 59.74 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.135 0.974 . . . . 0.0 112.303 169.95 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.6 m -171.59 163.11 6.61 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.955 2.102 . . . . 0.0 112.146 178.503 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 54.4 p90 -147.31 154.71 41.28 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.594 1.158 . . . . 0.0 111.787 176.154 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.4 t -95.95 129.39 46.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 125.204 1.402 . . . . 0.0 107.275 172.927 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 57.8 tp -99.39 134.72 41.85 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 124.167 0.987 . . . . 0.0 109.528 173.984 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 -127.84 155.39 44.2 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.107 1.363 . . . . 0.0 110.641 -177.922 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 10.1 t90 -125.36 137.3 54.03 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.634 1.174 . . . . 0.0 111.628 178.868 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -132.81 150.93 52.11 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.228 1.411 . . . . 0.0 113.347 -176.392 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -112.73 141.5 46.45 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.794 1.638 . . . . 0.0 109.178 168.992 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 81.2 mmm -74.19 133.39 42.73 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.057 0.543 . . . . 0.0 111.34 173.755 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 50.0 m -86.04 157.52 56.85 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 124.65 1.18 . . . . 0.0 111.783 172.807 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -57.57 -28.25 80.34 Favored 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 123.905 3.07 . . . . 0.0 114.284 174.97 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 25.2 p -77.03 3.81 11.51 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 126.022 1.729 . . . . 0.0 114.033 174.868 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 67.53 20.96 9.65 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 127.308 2.243 . . . . 0.0 112.932 -174.021 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -90.13 -172.65 3.56 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.958 1.303 . . . . 0.0 109.925 169.045 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.0 p -138.98 145.65 39.97 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.025 1.33 . . . . 0.0 110.347 -177.717 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -122.67 134.56 54.48 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 123.775 0.83 . . . . 0.0 111.569 173.154 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -75.23 137.52 41.3 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.96 0.904 . . . . 0.0 111.174 179.406 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 52.0 mt -114.55 -39.78 3.73 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.384 1.474 . . . . 0.0 112.865 -169.916 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -171.7 175.29 4.03 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.619 1.968 . . . . 0.0 110.175 -176.126 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -157.06 167.72 29.61 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.936 1.294 . . . . 0.0 112.096 179.844 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -145.23 115.44 4.99 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 125.76 1.624 . . . . 0.0 109.378 169.345 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_exo -53.44 148.7 15.41 Favored 'Cis proline' 0 C--N 1.352 0.713 0 CA-C-N 120.22 1.114 . . . . 0.0 113.546 -5.573 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -67.08 152.78 45.14 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 -170.221 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.1 t0 -142.93 140.55 31.18 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.597 1.559 . . . . 0.0 111.714 -172.363 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.4 mmm180 -101.73 -77.62 0.55 Allowed 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.777 1.231 . . . . 0.0 111.031 173.163 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 41.1 m 59.36 -58.56 0.05 Allowed 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 128.616 2.766 . . . . 0.0 117.639 169.815 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -135.87 157.06 76.75 Favored Pre-proline 0 CA--C 1.544 0.74 0 C-N-CA 126.391 1.876 . . . . 0.0 112.25 -170.68 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -61.45 147.73 94.73 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 122.765 2.31 . . . . 0.0 110.099 166.779 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 104.09 -17.15 48.92 Favored Glycine 0 N--CA 1.47 0.931 0 C-N-CA 124.357 0.98 . . . . 0.0 112.989 -179.823 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -83.55 62.94 7.1 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 118.13 0.965 . . . . 0.0 110.255 168.963 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -70.51 154.15 42.17 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.494 1.518 . . . . 0.0 112.859 -178.897 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 26.8 t -59.68 -23.07 62.79 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.001 1.32 . . . . 0.0 113.784 -177.16 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 30.4 ptt-85 -68.43 -23.0 64.57 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 113.893 1.072 . . . . 0.0 113.893 178.597 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 84.6 m-85 -93.83 123.41 37.16 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.488 1.115 . . . . 0.0 110.013 176.078 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -139.02 144.68 38.98 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.146 0.978 . . . . 0.0 111.645 -175.267 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 57.5 t -126.55 126.73 69.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 125.36 1.464 . . . . 0.0 109.379 -179.428 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 86.4 m -130.53 137.75 49.87 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.876 1.271 . . . . 0.0 110.421 -176.109 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -82.17 141.93 32.63 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.358 0.599 . . . . 0.0 112.459 172.249 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 39.2 mt -77.9 161.05 72.67 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 123.419 0.687 . . . . 0.0 110.898 169.37 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -68.37 -4.16 12.32 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 123.435 2.757 . . . . 0.0 113.562 171.699 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.81 -23.05 65.98 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 124.33 1.052 . . . . 0.0 112.494 172.005 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 93.66 -18.43 56.52 Favored Glycine 0 N--CA 1.477 1.428 0 C-N-CA 125.646 1.593 . . . . 0.0 114.715 170.695 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 27.1 ptt180 -154.59 73.66 0.91 Allowed 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 126.085 1.754 . . . . 0.0 109.204 170.08 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -173.8 147.53 1.36 Allowed 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 128.308 2.643 . . . . 0.0 108.462 -178.461 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 25.0 m-85 -146.86 157.08 43.56 Favored 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 113.958 1.096 . . . . 0.0 113.958 -166.383 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -116.55 143.09 46.04 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.193 1.797 . . . . 0.0 110.744 169.014 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 39.8 mtt -126.85 120.64 29.74 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.975 1.31 . . . . 0.0 109.95 177.615 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 69.0 m -120.42 128.21 52.98 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 114.263 1.208 . . . . 0.0 114.263 -168.041 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 21.6 t -94.6 98.88 8.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 N-CA-C 105.958 -1.868 . . . . 0.0 105.958 167.017 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 92.8 t -70.5 125.43 28.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.597 1.159 . . . . 0.0 109.182 -179.035 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 75.8 ttt180 52.35 65.59 1.46 Allowed 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.21 1.404 . . . . 0.0 110.929 179.181 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.26 130.57 43.29 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 121.327 -0.858 . . . . 0.0 111.721 -172.281 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 8.1 mpt_? -95.3 161.83 13.93 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.594 1.558 . . . . 0.0 110.086 175.266 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 89.8 mtm-85 -53.4 -36.92 61.98 Favored 'General case' 0 N--CA 1.482 1.141 0 O-C-N 121.151 -0.968 . . . . 0.0 112.708 179.732 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -62.35 -16.03 51.94 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.045 1.738 . . . . 0.0 114.845 176.264 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -80.53 -11.16 59.7 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 119.958 1.254 . . . . 0.0 113.272 176.234 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 21.2 m -63.91 132.23 50.12 Favored 'General case' 0 N--CA 1.477 0.878 0 O-C-N 120.534 -1.354 . . . . 0.0 112.586 -179.803 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 158.96 -167.32 34.79 Favored Glycine 0 N--CA 1.472 1.042 0 O-C-N 121.162 -0.961 . . . . 0.0 113.725 -177.68 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.2 m -93.4 138.31 31.86 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.888 1.275 . . . . 0.0 110.721 -178.045 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -135.9 156.46 48.73 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.804 1.641 . . . . 0.0 112.556 -177.647 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -160.25 148.62 16.82 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.808 1.243 . . . . 0.0 112.332 179.184 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 4.5 m -89.13 170.49 10.57 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.293 0.568 . . . . 0.0 111.999 172.49 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -155.04 115.6 0.67 Allowed Glycine 0 CA--C 1.526 0.765 0 C-N-CA 124.532 1.063 . . . . 0.0 111.673 168.435 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -87.82 156.26 19.48 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 117.791 0.795 . . . . 0.0 111.638 172.458 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 17.8 tt -154.43 130.19 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 124.602 1.161 . . . . 0.0 110.791 174.297 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 22.8 m -67.92 159.28 30.85 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.648 1.179 . . . . 0.0 113.402 -178.25 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.81 -9.91 48.34 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 115.578 1.696 . . . . 0.0 115.578 179.012 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -75.05 142.93 76.65 Favored Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 124.335 1.054 . . . . 0.0 112.265 -179.142 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_exo -56.14 -27.75 66.96 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 123.607 2.871 . . . . 0.0 114.658 174.736 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -84.51 0.98 47.78 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.819 1.248 . . . . 0.0 114.309 -179.49 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.88 164.52 17.26 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 124.4 1.08 . . . . 0.0 113.683 -177.213 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -146.1 152.44 39.31 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.76 1.624 . . . . 0.0 109.424 178.681 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 64.9 mt -71.46 123.37 25.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 124.28 1.032 . . . . 0.0 111.023 -174.774 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -83.72 88.38 7.07 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.451 1.501 . . . . 0.0 110.742 178.268 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -74.86 152.86 38.88 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.882 0.873 . . . . 0.0 110.566 171.353 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 58.8 m -157.35 -177.39 6.56 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.104 1.362 . . . . 0.0 112.24 179.528 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.5 tt -55.65 106.96 0.29 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.316 1.846 . . . . 0.0 113.083 -170.627 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.33 156.52 15.54 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.8 1.64 . . . . 0.0 114.762 -175.538 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -118.77 169.65 9.66 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 126.865 2.066 . . . . 0.0 111.558 177.559 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -130.82 144.94 51.81 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.844 1.257 . . . . 0.0 111.821 179.605 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 55.1 tp -115.21 134.8 54.81 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 126.417 1.887 . . . . 0.0 110.178 173.771 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 60.0 ttt85 -125.9 120.62 30.89 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.791 1.636 . . . . 0.0 109.755 171.207 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 46.6 t -106.43 114.71 46.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 124.833 1.253 . . . . 0.0 108.763 174.9 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 70.3 p -98.64 146.04 26.25 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.948 1.699 . . . . 0.0 110.416 -177.972 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 -59.05 146.98 36.48 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -172.355 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 20.0 ttp-105 -72.7 124.58 25.6 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 124.594 1.158 . . . . 0.0 108.803 -176.036 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 33.9 ptt-85 -143.2 160.23 40.84 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.342 1.057 . . . . 0.0 113.122 -166.97 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -72.94 154.29 40.61 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.625 1.17 . . . . 0.0 112.553 175.349 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 . . . . . 0 C--O 1.254 1.301 0 C-N-CA 127.273 2.229 . . . . 0.0 113.409 176.696 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 25.6 ptp . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 118.418 -0.801 . . . . 0.0 111.394 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_exo -59.89 162.48 15.96 Favored 'Trans proline' 0 CA--C 1.545 1.051 0 C-N-CA 123.955 3.103 . . . . 0.0 113.088 173.95 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -51.4 117.16 3.2 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 124.659 3.573 . . . . 0.0 113.392 177.81 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.2 t -158.96 155.05 26.88 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.147 1.379 . . . . 0.0 112.016 -175.541 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -129.45 132.92 47.07 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.002 1.721 . . . . 0.0 110.761 -171.05 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 92.8 p -140.86 154.99 69.22 Favored Pre-proline 0 CA--C 1.55 0.98 0 N-CA-C 113.893 1.071 . . . . 0.0 113.893 -172.283 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -66.98 160.07 79.03 Favored 'Cis proline' 0 C--N 1.353 0.804 0 CA-C-N 119.409 0.825 . . . . 0.0 111.497 -6.405 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.86 -28.68 66.33 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 176.521 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 47.8 tp -141.13 122.59 15.01 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.586 1.554 . . . . 0.0 109.049 170.252 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 54.6 tp -105.84 126.11 51.79 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.033 1.333 . . . . 0.0 109.32 170.926 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.4 t -109.08 123.77 65.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 124.028 0.931 . . . . 0.0 108.915 173.164 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.3 m -127.93 170.05 18.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 125.047 1.339 . . . . 0.0 111.474 172.86 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 18.4 m -98.16 151.74 20.1 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.472 1.509 . . . . 0.0 110.39 173.856 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -47.92 127.48 12.11 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.568 1.147 . . . . 0.0 111.45 168.777 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 86.24 -1.05 87.55 Favored Glycine 0 CA--C 1.532 1.137 0 C-N-CA 125.306 1.431 . . . . 0.0 114.664 -178.044 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.5 t0 -89.14 160.3 17.07 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.664 1.732 . . . . 0.0 111.912 173.786 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 71.4 m-20 -93.68 118.71 31.75 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.418 1.087 . . . . 0.0 110.191 175.343 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -97.88 120.44 38.28 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.875 1.27 . . . . 0.0 110.791 -179.992 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 23.1 m -125.38 125.82 44.03 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.593 0.757 . . . . 0.0 111.049 178.99 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -102.31 159.36 15.48 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.2 1.8 . . . . 0.0 111.034 172.078 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 71.3 m -113.4 126.82 55.77 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.722 1.609 . . . . 0.0 109.375 175.848 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -118.3 127.62 53.88 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.91 1.284 . . . . 0.0 111.525 179.012 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 57.6 m -118.91 139.36 51.77 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.983 1.313 . . . . 0.0 109.877 -172.278 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.427 ' CE1' HD21 ' A' ' 65' ' ' LEU . 38.1 m-85 -136.78 155.07 50.31 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -169.651 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.3 t -153.78 105.84 2.82 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.747 1.619 . . . . 0.0 108.02 168.262 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -118.25 154.7 31.82 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.682 1.193 . . . . 0.0 112.816 -169.388 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 13.6 t -73.06 -28.83 62.54 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.068 0.947 . . . . 0.0 110.9 167.658 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 17.1 m -56.9 116.16 3.02 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.269 1.828 . . . . 0.0 111.809 169.822 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -75.5 -20.43 58.75 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.162 0.985 . . . . 0.0 112.637 176.478 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 67.0 p -151.98 146.78 25.85 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.023 1.729 . . . . 0.0 109.686 171.812 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 30.8 p90 -165.91 160.88 17.23 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -168.607 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 57.6 t -95.99 132.59 39.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 125.482 1.513 . . . . 0.0 107.038 167.465 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.427 HD21 ' CE1' ' A' ' 56' ' ' PHE . 0.2 OUTLIER -99.31 113.48 25.81 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.849 0.86 . . . . 0.0 109.256 176.31 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 -106.19 145.97 30.86 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.153 1.381 . . . . 0.0 111.177 179.91 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 18.5 t90 -114.83 136.36 53.18 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.669 1.188 . . . . 0.0 111.018 176.511 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -130.1 145.18 51.67 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.83 1.252 . . . . 0.0 113.998 -173.012 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 52.3 ttp85 -101.12 144.45 29.99 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 126.409 1.884 . . . . 0.0 107.64 167.017 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 33.5 mtp -90.26 145.79 24.73 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 118.948 0.794 . . . . 0.0 112.212 173.507 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 41.2 m -111.45 149.88 41.29 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 125.649 1.58 . . . . 0.0 111.071 173.805 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -69.32 -14.54 37.66 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 124.333 3.356 . . . . 0.0 114.164 -170.424 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.2 m -76.79 10.39 2.26 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.687 1.195 . . . . 0.0 112.929 171.162 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 68.15 48.82 0.9 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 127.434 2.294 . . . . 0.0 111.021 -176.565 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 26.9 mm-40 -130.72 175.71 8.8 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.441 1.496 . . . . 0.0 110.736 -178.523 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.0 p -136.13 150.99 49.32 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.938 1.695 . . . . 0.0 111.107 -177.354 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 39.6 t0 -133.99 127.72 32.93 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.573 1.549 . . . . 0.0 110.745 -177.798 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 30.6 ttmt -74.23 129.05 37.08 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.689 0.796 . . . . 0.0 110.734 -178.917 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 78.4 mt -101.35 -49.09 4.16 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 125.159 1.384 . . . . 0.0 112.294 -175.147 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -165.78 176.74 7.71 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 127.044 2.137 . . . . 0.0 109.409 -178.853 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -157.44 167.22 30.84 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.767 0.827 . . . . 0.0 113.003 -176.87 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -139.52 117.0 8.56 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 125.557 1.543 . . . . 0.0 109.4 169.405 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -55.08 154.52 20.26 Favored 'Cis proline' 0 C--N 1.352 0.73 0 CA-C-N 120.502 1.215 . . . . 0.0 113.656 -6.302 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -58.9 134.06 56.59 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.094 1.358 . . . . 0.0 113.741 -171.041 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -81.17 -0.79 41.95 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.671 1.189 . . . . 0.0 113.476 178.36 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 57.0 mtt85 -60.64 -9.53 4.0 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.53 1.932 . . . . 0.0 114.616 -177.644 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.4 p -65.43 -20.28 66.3 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.407 1.083 . . . . 0.0 113.01 169.452 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -116.44 152.97 48.74 Favored Pre-proline 0 CA--C 1.547 0.857 0 C-N-CA 125.717 1.607 . . . . 0.0 110.798 172.884 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -77.73 163.41 29.05 Favored 'Trans proline' 0 CA--C 1.538 0.698 0 C-N-CA 123.741 2.961 . . . . 0.0 111.453 175.737 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 98.23 18.36 26.71 Favored Glycine 0 CA--C 1.528 0.894 0 C-N-CA 124.159 0.885 . . . . 0.0 113.392 177.327 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 14.4 mm-40 -118.61 161.87 19.33 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.135 1.374 . . . . 0.0 111.003 173.811 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -142.91 136.19 28.37 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.261 1.024 . . . . 0.0 112.88 -173.3 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 51.1 m -69.2 -9.48 53.16 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 115.824 1.787 . . . . 0.0 115.824 -173.244 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 12.5 mmt85 -62.56 -20.34 64.59 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 119.728 1.149 . . . . 0.0 112.915 169.988 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -111.91 136.3 51.4 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.064 1.746 . . . . 0.0 110.081 174.311 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 12.1 mtm180 -144.52 149.26 35.61 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.7 1.2 . . . . 0.0 112.715 179.108 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 43.9 t -126.5 131.19 71.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 C-N-CA 125.69 1.596 . . . . 0.0 109.652 175.713 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 89.1 m -130.5 136.45 48.98 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.728 1.211 . . . . 0.0 110.407 178.269 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -80.28 141.89 35.08 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 118.566 0.621 . . . . 0.0 112.081 174.759 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 19.6 mt -85.48 158.62 57.15 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 123.751 0.82 . . . . 0.0 111.271 169.75 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -66.15 -4.55 10.58 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 123.656 2.904 . . . . 0.0 114.201 174.306 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -61.13 -26.15 67.48 Favored 'General case' 0 CA--C 1.551 1.007 0 CA-C-N 119.49 1.041 . . . . 0.0 112.835 169.699 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 98.73 -34.07 5.6 Favored Glycine 0 CA--C 1.531 1.078 0 C-N-CA 126.113 1.816 . . . . 0.0 114.224 172.708 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 57.1 mtm180 -135.36 73.59 1.48 Allowed 'General case' 0 N--CA 1.475 0.785 0 CA-C-O 122.616 1.198 . . . . 0.0 109.589 169.314 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -168.19 143.9 3.75 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 127.337 2.255 . . . . 0.0 108.651 -179.735 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -145.76 148.21 32.73 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.736 0.815 . . . . 0.0 112.833 -167.691 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -104.66 129.17 52.86 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.076 1.351 . . . . 0.0 110.673 168.827 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.4 mpt? -113.21 114.02 26.16 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 126.252 1.821 . . . . 0.0 108.987 -178.924 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 34.7 t -118.91 126.82 52.66 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.768 1.025 . . . . 0.0 113.768 -169.348 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 22.8 t -101.0 113.04 35.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 167.838 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 3.6 m -89.29 139.28 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-N 118.506 0.594 . . . . 0.0 111.864 179.424 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 19.9 tpt180 56.07 51.37 12.03 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.129 1.772 . . . . 0.0 111.712 173.658 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.12 158.96 24.49 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 114.589 1.329 . . . . 0.0 114.589 -168.81 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 4.8 ptm180 -135.77 151.83 50.5 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 127.816 2.446 . . . . 0.0 109.605 -172.159 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 36.1 mtp180 -53.35 -37.55 62.48 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 114.387 1.254 . . . . 0.0 114.387 -169.628 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -65.43 -13.79 59.49 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 125.053 1.341 . . . . 0.0 114.546 177.217 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -72.49 -16.69 61.79 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.978 1.263 . . . . 0.0 112.689 172.96 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.6 m -62.05 132.8 54.08 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.073 -1.017 . . . . 0.0 112.505 -177.388 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 159.76 -167.09 35.19 Favored Glycine 0 N--CA 1.473 1.112 0 C-N-CA 124.227 0.918 . . . . 0.0 114.031 -174.654 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.9 m -94.46 144.46 25.54 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.274 1.43 . . . . 0.0 110.977 -178.032 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -144.65 155.08 43.42 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.588 1.555 . . . . 0.0 111.789 -175.375 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -160.65 161.58 32.45 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.94 1.296 . . . . 0.0 113.441 179.511 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 3.5 m -104.67 162.74 13.02 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.342 1.457 . . . . 0.0 111.449 179.057 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -153.19 134.52 4.46 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 123.89 0.757 . . . . 0.0 113.369 169.883 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -99.27 126.78 45.17 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.981 0.913 . . . . 0.0 110.777 173.64 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 16.7 tt -122.28 131.36 73.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 O-C-N 121.266 -0.896 . . . . 0.0 110.857 174.888 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.2 m -61.22 157.96 15.11 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.515 1.126 . . . . 0.0 113.151 -177.92 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 39.0 mt -73.15 -14.23 61.33 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 -178.752 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -69.55 154.3 94.95 Favored Pre-proline 0 CA--C 1.552 1.055 0 C-N-CA 125.061 1.344 . . . . 0.0 112.821 176.097 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.87 -24.69 24.29 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 123.011 2.474 . . . . 0.0 112.975 176.958 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 17.2 ttpp -89.09 13.36 13.25 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 125.248 1.419 . . . . 0.0 113.461 -179.433 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.78 168.08 10.21 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.564 1.546 . . . . 0.0 114.754 -173.64 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -142.97 147.67 35.57 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.209 1.804 . . . . 0.0 109.219 177.372 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 42.8 mt -80.83 125.1 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 123.995 0.918 . . . . 0.0 111.006 -175.04 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 32.2 mmtm -88.05 93.92 9.64 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.955 1.302 . . . . 0.0 107.983 169.361 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -79.24 139.64 37.86 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.621 0.769 . . . . 0.0 112.021 -174.178 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 69.4 m -84.5 156.06 21.88 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.395 1.078 . . . . 0.0 113.33 175.073 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 89.0 mt -62.2 135.75 57.63 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 168.44 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.82 165.14 25.46 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 115.428 1.64 . . . . 0.0 115.428 -169.679 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -129.59 169.53 14.91 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 127.07 2.148 . . . . 0.0 110.55 169.548 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -122.46 142.33 50.67 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.818 1.247 . . . . 0.0 111.477 176.651 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 60.7 tp -110.34 136.27 49.77 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 125.946 1.698 . . . . 0.0 109.91 172.012 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 68.2 ttt180 -127.61 121.66 31.1 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.682 1.593 . . . . 0.0 109.756 170.07 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 45.2 t -108.0 111.85 37.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 C-N-CA 124.977 1.311 . . . . 0.0 108.641 172.755 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 75.4 p -90.8 155.2 18.96 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 125.945 1.698 . . . . 0.0 110.694 -179.647 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -65.21 148.9 50.86 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.946 0.898 . . . . 0.0 113.385 -172.463 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 34.2 ttp-105 -66.08 118.31 9.65 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 124.602 1.161 . . . . 0.0 109.828 -175.405 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 75.8 mtp85 -75.41 153.67 37.56 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.16 0.584 . . . . 0.0 112.418 -169.882 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -70.41 154.28 42.06 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.482 1.113 . . . . 0.0 112.442 174.66 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 . . . . . 0 C--O 1.253 1.283 0 C-N-CA 125.197 1.399 . . . . 0.0 112.97 177.304 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 39.7 ttp . . . . . 0 N--CA 1.489 1.486 0 CA-C-O 118.45 -0.786 . . . . 0.0 110.456 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_endo -66.82 167.4 19.61 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.962 2.441 . . . . 0.0 111.183 175.589 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -54.64 153.57 23.37 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 123.36 2.707 . . . . 0.0 114.081 178.873 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.8 t -147.98 145.6 28.61 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 125.271 1.429 . . . . 0.0 109.793 171.591 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -121.24 144.02 48.83 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.418 1.087 . . . . 0.0 112.301 -168.459 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 79.9 p -140.91 153.88 67.92 Favored Pre-proline 0 CA--C 1.547 0.85 0 N-CA-C 113.728 1.011 . . . . 0.0 113.728 168.732 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -70.43 159.92 90.9 Favored 'Cis proline' 0 C--N 1.352 0.738 0 CA-C-N 118.96 0.664 . . . . 0.0 111.092 -10.066 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.57 -30.44 69.79 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 173.05 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 48.0 tp -138.52 120.26 15.25 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.52 1.528 . . . . 0.0 109.005 170.103 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 41.8 tp -102.01 127.16 49.0 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.132 1.373 . . . . 0.0 109.403 172.781 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.8 t -112.43 123.1 67.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 124.022 0.929 . . . . 0.0 108.925 173.57 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.5 m -128.5 166.38 25.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 C-N-CA 124.687 1.195 . . . . 0.0 112.195 173.55 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.0 m -88.51 150.11 23.28 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.938 1.295 . . . . 0.0 110.522 172.339 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -51.73 124.95 13.6 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.587 1.155 . . . . 0.0 111.639 173.684 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 86.25 -0.87 87.48 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 124.849 1.214 . . . . 0.0 114.593 -178.412 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -85.62 158.92 19.97 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 119.598 1.699 . . . . 0.0 111.52 171.428 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 8.0 p30 -86.02 130.05 34.65 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.506 0.722 . . . . 0.0 111.276 172.145 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -111.07 119.58 39.5 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.325 1.45 . . . . 0.0 110.76 -178.161 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 34.4 m -120.55 125.57 48.15 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.985 0.914 . . . . 0.0 111.675 -176.482 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -99.99 153.12 19.45 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.739 1.615 . . . . 0.0 110.406 169.126 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 37.2 m -103.8 131.35 51.07 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.27 1.428 . . . . 0.0 108.858 171.583 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 46.4 t -121.29 124.21 44.06 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.979 1.312 . . . . 0.0 111.082 171.521 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 24.0 t -125.26 146.3 49.61 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.161 1.385 . . . . 0.0 111.181 179.964 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 34.6 p90 -160.59 156.17 25.29 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.07 1.348 . . . . 0.0 112.188 -170.042 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 69.4 m -138.92 101.38 4.28 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 121.323 -0.861 . . . . 0.0 110.961 169.026 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -78.31 145.7 35.18 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.493 0.717 . . . . 0.0 112.421 -179.212 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 19.0 m -76.03 -32.47 59.38 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.261 1.424 . . . . 0.0 111.467 173.375 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 51.3 p -81.57 -179.07 7.23 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.236 1.815 . . . . 0.0 112.721 173.351 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -139.07 131.37 28.37 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.753 1.621 . . . . 0.0 110.096 -179.827 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.4 t 82.07 117.72 0.05 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 128.482 2.713 . . . . 0.0 111.399 -175.771 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 5.0 p90 -169.18 164.12 11.05 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.141 1.376 . . . . 0.0 112.66 -167.675 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 48.0 t -109.61 137.85 39.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 126.286 1.834 . . . . 0.0 108.52 170.866 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 15.9 tp -102.94 130.79 50.12 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 123.641 0.776 . . . . 0.0 109.619 170.074 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -126.08 158.07 36.39 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.358 1.463 . . . . 0.0 111.568 -171.495 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 15.2 t90 -130.5 138.62 50.34 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.435 1.094 . . . . 0.0 112.149 -176.761 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -139.82 147.73 41.15 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.518 1.127 . . . . 0.0 113.436 -171.928 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 79.4 ttt-85 -110.93 138.29 47.51 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.542 1.537 . . . . 0.0 108.852 168.519 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 37.7 mtp -86.39 145.9 26.68 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 119.348 0.976 . . . . 0.0 112.492 177.046 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.1 p -86.01 163.0 44.98 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 123.824 0.849 . . . . 0.0 111.929 170.689 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -67.53 -19.45 48.59 Favored 'Trans proline' 0 C--N 1.354 0.85 0 C-N-CA 122.639 2.226 . . . . 0.0 112.575 171.574 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 21.9 m -82.41 12.54 4.38 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.135 1.374 . . . . 0.0 112.806 170.029 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . 0.312 0.4 OUTLIER 61.58 21.71 12.32 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 128.252 2.621 . . . . 0.0 115.574 179.185 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 17.7 mm100 -89.25 -172.68 3.73 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.072 0.949 . . . . 0.0 109.634 168.858 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.4 p -141.59 141.83 33.47 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.601 1.561 . . . . 0.0 110.318 -174.897 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -118.01 131.44 56.48 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 125.026 1.33 . . . . 0.0 110.369 175.582 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 55.4 tttm -83.07 119.42 24.46 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.554 1.141 . . . . 0.0 110.744 -174.285 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 74.6 mt -92.56 -49.45 6.1 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 124.731 1.213 . . . . 0.0 112.313 -169.206 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -172.55 175.32 3.53 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 127.005 2.122 . . . . 0.0 109.982 -173.206 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.61 172.15 18.32 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.992 1.317 . . . . 0.0 112.2 -178.686 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -143.5 118.42 6.24 Favored Pre-proline 0 CA--C 1.547 0.838 0 C-N-CA 124.809 1.244 . . . . 0.0 110.279 169.102 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -61.73 158.46 55.16 Favored 'Cis proline' 0 C--N 1.351 0.708 0 CA-C-N 119.154 0.733 . . . . 0.0 111.192 -10.183 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -74.96 94.5 2.84 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 122.05 0.928 . . . . 0.0 110.241 -179.86 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -76.6 -8.16 56.67 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.662 1.185 . . . . 0.0 114.16 -170.765 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 49.7 ptt85 -64.61 -32.2 73.75 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.434 1.493 . . . . 0.0 113.311 175.647 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.6 t 66.35 -61.18 0.3 Allowed 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 127.77 2.428 . . . . 0.0 113.214 -177.062 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -87.59 167.43 20.73 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 126.266 1.826 . . . . 0.0 110.797 173.605 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -56.61 132.75 53.68 Favored 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 123.378 2.718 . . . . 0.0 112.191 171.589 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -154.57 19.99 0.61 Allowed Glycine 0 N--CA 1.473 1.136 0 C-N-CA 124.503 1.049 . . . . 0.0 114.679 -177.798 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -163.04 169.89 18.83 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 126.804 2.041 . . . . 0.0 110.583 -169.822 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -82.15 158.99 23.43 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-O 121.45 0.643 . . . . 0.0 109.841 167.552 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.7 m -72.17 -1.97 17.0 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.449 1.1 . . . . 0.0 113.507 -179.421 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 84.4 mtt-85 -75.66 -35.08 60.49 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.643 1.577 . . . . 0.0 112.647 -179.33 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -91.7 116.35 28.81 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.454 1.101 . . . . 0.0 111.345 -169.65 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 -137.81 139.66 40.11 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.165 0.986 . . . . 0.0 111.029 -170.455 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 97.2 t -126.5 125.53 67.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 125.288 1.435 . . . . 0.0 109.487 -177.889 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 90.7 m -130.28 129.39 43.19 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.911 1.284 . . . . 0.0 110.935 -173.768 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -78.09 137.65 38.34 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.611 1.164 . . . . 0.0 111.188 178.291 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 51.0 mt -92.61 159.4 36.58 Favored Pre-proline 0 CA--C 1.545 0.772 0 C-N-CA 124.603 1.161 . . . . 0.0 111.823 177.437 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -64.96 -6.82 13.54 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 123.515 2.81 . . . . 0.0 113.993 173.573 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -68.43 -11.62 59.99 Favored 'General case' 0 CA--C 1.557 1.244 0 CA-C-N 119.336 0.971 . . . . 0.0 112.688 169.608 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 88.4 -34.16 3.91 Favored Glycine 0 N--CA 1.475 1.235 0 C-N-CA 126.964 2.221 . . . . 0.0 115.612 168.77 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 23.7 ptt-85 -140.5 73.61 1.43 Allowed 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 123.865 1.793 . . . . 0.0 109.925 172.008 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -169.54 137.83 1.84 Allowed 'General case' 0 C--O 1.237 0.446 0 C-N-CA 127.251 2.22 . . . . 0.0 107.195 -170.884 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 -143.86 137.97 28.3 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -167.642 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -92.28 126.07 37.2 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.432 1.093 . . . . 0.0 109.178 167.161 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 40.0 mtt -120.31 112.22 18.75 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 125.309 1.443 . . . . 0.0 108.793 -178.496 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 60.9 m -115.88 132.02 56.77 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 114.727 1.38 . . . . 0.0 114.727 -166.998 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 33.5 t -97.7 91.34 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 N-CA-C 105.777 -1.934 . . . . 0.0 105.777 166.743 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 86.0 t -73.54 121.48 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 123.764 0.825 . . . . 0.0 109.551 -178.971 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 59.39 73.88 0.46 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.007 1.723 . . . . 0.0 111.4 -175.675 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -79.97 147.86 31.41 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.372 1.469 . . . . 0.0 112.93 -175.91 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -116.48 162.75 17.1 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 126.904 2.082 . . . . 0.0 110.459 179.044 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 83.6 mtm-85 -56.18 -24.98 44.98 Favored 'General case' 0 N--CA 1.483 1.176 0 O-C-N 121.174 -0.954 . . . . 0.0 113.555 171.505 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -65.37 -25.36 67.54 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 124.816 1.246 . . . . 0.0 114.112 171.63 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -81.86 -26.69 34.01 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.924 0.89 . . . . 0.0 112.649 -179.622 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 45.4 m -48.78 133.0 17.89 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.337 1.055 . . . . 0.0 112.43 177.239 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 150.67 -162.0 29.19 Favored Glycine 0 N--CA 1.469 0.84 0 C-N-CA 123.839 0.733 . . . . 0.0 113.196 -172.784 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.9 m -96.1 140.86 30.21 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.289 1.436 . . . . 0.0 110.902 -172.706 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -134.13 156.22 48.68 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.642 1.577 . . . . 0.0 112.824 -177.159 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -155.17 156.19 35.26 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.264 1.426 . . . . 0.0 112.66 173.63 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -119.93 137.27 54.14 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.338 1.855 . . . . 0.0 109.847 176.144 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -141.74 132.44 5.25 Favored Glycine 0 N--CA 1.471 0.995 0 C-N-CA 124.086 0.851 . . . . 0.0 113.51 -171.556 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -88.52 156.18 19.23 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.025 0.93 . . . . 0.0 112.001 175.253 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 17.7 tt -154.08 133.7 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 124.889 1.276 . . . . 0.0 110.43 173.965 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 77.3 p -77.45 161.59 27.85 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.423 1.089 . . . . 0.0 113.135 178.427 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.82 -2.09 11.2 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 115.297 1.592 . . . . 0.0 115.297 178.479 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -73.03 145.74 86.56 Favored Pre-proline 0 CA--C 1.551 1.012 0 C-N-CA 124.287 1.035 . . . . 0.0 112.512 -177.101 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -56.53 -30.31 82.12 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 123.408 2.739 . . . . 0.0 113.949 172.794 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 59.7 mtpt -88.98 5.05 46.05 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.131 1.372 . . . . 0.0 114.059 -178.305 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.4 162.22 18.19 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.429 1.092 . . . . 0.0 113.848 -175.758 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -150.5 151.3 32.47 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.928 1.691 . . . . 0.0 109.185 -178.881 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 52.0 mt -68.93 122.57 20.57 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 123.685 0.794 . . . . 0.0 110.436 -177.512 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -80.83 88.4 5.84 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.91 1.284 . . . . 0.0 110.181 175.726 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -76.93 158.78 30.48 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.539 1.536 . . . . 0.0 112.879 -179.118 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 6.1 t -147.57 -170.22 3.51 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.821 0.848 . . . . 0.0 113.003 169.889 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 92.6 mt -68.93 127.77 34.29 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.984 1.714 . . . . 0.0 111.23 -177.488 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 10.7 mpt_? -68.51 159.64 31.39 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 126.236 1.814 . . . . 0.0 115.132 -168.851 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.91 169.68 9.05 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 127.256 2.222 . . . . 0.0 110.63 168.709 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -131.01 144.04 51.17 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.584 1.153 . . . . 0.0 112.334 -177.103 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 64.2 tp -112.93 137.62 51.04 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 126.374 1.87 . . . . 0.0 110.206 171.604 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 72.1 ttt180 -127.95 119.27 25.17 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.702 1.601 . . . . 0.0 109.851 169.812 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 41.5 t -100.89 118.68 47.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 124.673 1.189 . . . . 0.0 108.22 169.204 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 75.2 p -97.52 157.84 15.8 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.69 1.596 . . . . 0.0 110.785 178.955 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 56.7 mp0 -62.29 151.56 36.14 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.341 1.056 . . . . 0.0 112.332 -179.347 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 39.0 ttm105 -71.36 117.35 12.78 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 124.102 0.961 . . . . 0.0 110.332 -177.125 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 47.9 mtm105 -75.82 154.51 36.13 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.931 0.893 . . . . 0.0 112.26 -173.064 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -70.71 154.34 41.95 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.527 1.131 . . . . 0.0 112.403 174.499 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 . . . . . 0 C--O 1.252 1.226 0 C-N-CA 125.215 1.406 . . . . 0.0 112.99 177.109 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 33' ' ' MET . . . . . 0.639 ' N ' ' HG ' ' A' ' 57' ' ' SER . 1.7 pmm? . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 118.788 -0.625 . . . . 0.0 111.545 . . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo -58.82 155.3 38.73 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 123.907 3.071 . . . . 0.0 112.115 169.946 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -67.57 126.73 15.24 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 123.385 2.723 . . . . 0.0 110.758 -179.244 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.3 t -153.51 156.87 38.91 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.978 0.911 . . . . 0.0 112.309 -175.573 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 57.4 t80 -150.56 118.2 6.15 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 127.217 2.207 . . . . 0.0 109.405 -174.495 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 98.2 p -140.94 160.87 56.7 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 124.49 1.116 . . . . 0.0 113.704 -170.632 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -70.64 164.0 82.87 Favored 'Cis proline' 0 C--N 1.354 0.859 0 CA-C-N 119.91 1.003 . . . . 0.0 111.548 -6.561 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.44 -23.57 66.97 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 175.0 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 44.4 tp -142.2 122.82 14.2 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.617 1.567 . . . . 0.0 108.785 171.024 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 61.4 tp -110.68 125.83 53.88 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.086 1.354 . . . . 0.0 109.07 170.685 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 12.6 p -108.04 128.37 63.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 123.969 0.907 . . . . 0.0 109.775 169.826 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.7 m -128.78 168.22 22.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 125.096 1.359 . . . . 0.0 111.716 172.924 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 88.4 m -90.72 148.83 22.33 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.372 1.069 . . . . 0.0 110.37 171.581 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -57.14 117.03 3.63 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.989 1.716 . . . . 0.0 111.174 175.743 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.0 5.62 65.91 Favored Glycine 0 CA--C 1.532 1.136 0 C-N-CA 125.464 1.506 . . . . 0.0 114.694 -175.252 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -97.06 158.16 15.56 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 119.435 1.618 . . . . 0.0 112.324 173.22 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 -72.81 131.83 42.79 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.73 1.212 . . . . 0.0 111.199 173.845 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -117.86 114.01 22.62 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.562 1.145 . . . . 0.0 111.186 178.757 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 32.8 m -124.72 125.33 43.91 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.536 0.734 . . . . 0.0 111.905 -174.273 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -101.46 158.13 16.3 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.513 1.925 . . . . 0.0 110.4 169.965 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 28.1 m -102.67 137.39 40.96 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.349 1.46 . . . . 0.0 109.597 172.684 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 39.1 t -130.28 142.76 50.53 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.068 1.347 . . . . 0.0 111.812 170.498 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.9 m -140.61 128.07 21.33 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.009 0.524 . . . . 0.0 112.285 -174.233 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 26.4 m-85 -139.37 156.1 47.22 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 126.826 2.05 . . . . 0.0 113.412 175.764 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.639 ' HG ' ' N ' ' A' ' 33' ' ' MET . 53.3 m -136.82 134.55 37.1 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 126.977 2.111 . . . . 0.0 107.006 166.696 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -162.47 -179.52 7.01 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 116.658 2.096 . . . . 0.0 116.658 -169.688 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 72.4 p -78.38 -179.5 6.35 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 127.681 2.392 . . . . 0.0 112.901 -171.747 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 16.9 m 68.06 15.69 9.46 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 126.582 1.953 . . . . 0.0 113.9 174.947 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 77.87 -30.87 0.16 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 128.292 2.637 . . . . 0.0 112.103 -174.619 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -164.62 -178.01 5.11 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.76 1.224 . . . . 0.0 113.319 169.766 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 35.1 p90 -144.72 162.66 36.16 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.465 1.506 . . . . 0.0 112.843 -169.596 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.3 t -95.98 125.08 48.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 N-CA-C 106.277 -1.749 . . . . 0.0 106.277 168.474 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 19.5 tp -101.94 134.84 44.5 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 123.569 0.748 . . . . 0.0 110.037 175.28 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 8.6 m-80 -132.03 145.79 51.66 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.832 1.253 . . . . 0.0 110.903 -169.773 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 11.5 t90 -111.43 140.65 45.84 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 124.596 1.158 . . . . 0.0 111.374 178.289 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -133.78 140.29 46.85 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 -175.668 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 68.3 ttt180 -96.58 140.0 31.84 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.268 1.027 . . . . 0.0 108.742 167.834 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 33.3 mtp -97.02 145.92 25.49 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -177.085 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.8 p -85.49 163.77 43.21 Favored Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 123.717 0.807 . . . . 0.0 111.355 169.258 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -67.76 -18.4 47.62 Favored 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 122.661 2.24 . . . . 0.0 112.763 172.781 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 32.7 m -83.34 1.55 40.67 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.635 1.174 . . . . 0.0 112.91 170.861 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 74.46 22.44 2.13 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 127.784 2.433 . . . . 0.0 113.759 179.424 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -83.34 177.07 8.66 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.213 0.605 . . . . 0.0 109.463 168.399 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 11.7 p -144.22 139.1 28.5 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.841 1.257 . . . . 0.0 111.098 -169.904 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -122.51 130.11 52.7 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.028 0.931 . . . . 0.0 111.5 174.679 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -73.01 126.94 31.13 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.372 0.669 . . . . 0.0 111.021 -179.258 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 43.4 mt -98.27 -46.37 5.84 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.739 1.615 . . . . 0.0 111.989 -173.698 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -167.83 167.79 12.76 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 127.167 2.187 . . . . 0.0 109.784 -174.04 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -156.75 160.2 39.05 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.392 1.077 . . . . 0.0 112.372 -176.212 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -133.76 130.67 20.79 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 124.861 1.264 . . . . 0.0 110.21 170.607 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -66.1 150.03 78.51 Favored 'Cis proline' 0 C--N 1.351 0.673 0 CA-C-N 119.932 1.012 . . . . 0.0 111.473 -3.928 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -79.08 150.77 31.74 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.139 0.975 . . . . 0.0 112.672 -176.008 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -100.31 157.43 16.61 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 122.194 0.997 . . . . 0.0 112.26 174.487 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -87.47 -2.55 58.69 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.32 1.848 . . . . 0.0 113.193 -169.273 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 43.0 p -76.12 -6.33 50.72 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.186 1.794 . . . . 0.0 114.087 176.198 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 -58.42 149.27 60.91 Favored Pre-proline 0 CA--C 1.552 1.037 0 C-N-CA 125.555 1.542 . . . . 0.0 113.178 177.282 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -77.48 173.65 13.91 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.855 3.037 . . . . 0.0 111.919 178.122 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -87.76 1.51 85.41 Favored Glycine 0 CA--C 1.533 1.196 0 C-N-CA 124.453 1.025 . . . . 0.0 113.203 172.851 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -86.02 168.05 14.47 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.614 1.566 . . . . 0.0 111.008 176.702 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -67.51 128.6 37.06 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.277 -0.889 . . . . 0.0 111.211 173.553 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 40.4 p -86.51 -12.2 49.52 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 114.903 1.445 . . . . 0.0 114.903 -171.501 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 12.4 mtp85 62.43 -35.39 0.12 Allowed 'General case' 0 C--N 1.344 0.36 0 C-N-CA 130.67 3.588 . . . . 0.0 115.344 -174.52 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -118.3 140.47 49.78 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.137 1.775 . . . . 0.0 111.318 -174.156 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 31.4 ttp-105 -140.11 144.1 36.59 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.163 1.385 . . . . 0.0 111.465 -174.493 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 46.3 t -121.87 127.87 75.53 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 C-N-CA 124.887 1.275 . . . . 0.0 108.485 169.18 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 89.3 m -130.6 134.88 47.35 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.173 1.389 . . . . 0.0 110.403 -174.365 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 22.1 pt20 -79.92 141.66 35.86 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.574 0.749 . . . . 0.0 111.887 173.851 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 72.3 mt -93.9 158.38 36.44 Favored Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 124.904 1.282 . . . . 0.0 111.675 178.171 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -65.56 -4.72 10.13 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 123.549 2.832 . . . . 0.0 113.848 174.209 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 21.2 m120 -65.19 -18.53 65.39 Favored 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 119.15 0.886 . . . . 0.0 113.044 169.97 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 95.66 -34.14 5.07 Favored Glycine 0 N--CA 1.474 1.168 0 C-N-CA 126.457 1.98 . . . . 0.0 114.241 169.884 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 90.4 mtt-85 -141.41 73.65 1.43 Allowed 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.571 1.549 . . . . 0.0 109.173 169.308 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -164.82 144.81 7.28 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 126.787 2.035 . . . . 0.0 108.087 178.706 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -142.65 147.35 35.61 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 -168.055 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -105.19 138.63 41.08 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.163 1.385 . . . . 0.0 110.917 168.884 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 31.5 mtt -121.42 108.66 13.93 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 126.238 1.815 . . . . 0.0 107.816 179.32 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 17.5 t -122.26 128.35 51.0 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 -165.994 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 12.9 t -88.32 124.9 41.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 125.269 1.428 . . . . 0.0 107.356 168.073 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 67.4 t -84.29 112.48 21.61 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 C-N-CA 124.916 1.287 . . . . 0.0 108.887 174.535 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 80.7 mtt85 54.97 70.39 0.63 Allowed 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.714 1.605 . . . . 0.0 111.656 175.997 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.64 128.46 36.05 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.196 0.998 . . . . 0.0 111.792 -174.391 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 10.1 mpt_? -89.22 161.94 16.16 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.945 1.298 . . . . 0.0 109.828 173.557 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 71.8 mtm180 -58.73 -23.72 60.32 Favored 'General case' 0 N--CA 1.484 1.255 0 O-C-N 120.628 -1.295 . . . . 0.0 113.578 172.676 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -55.01 -26.88 40.02 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.576 1.551 . . . . 0.0 113.367 167.99 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 34.9 m-20 -95.73 -1.22 50.33 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.584 1.554 . . . . 0.0 113.207 -169.46 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 69.4 m -64.4 138.31 58.35 Favored 'General case' 0 CA--C 1.544 0.727 0 O-C-N 120.401 -1.437 . . . . 0.0 111.643 169.837 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 160.1 -167.41 35.47 Favored Glycine 0 N--CA 1.473 1.12 0 O-C-N 121.167 -0.958 . . . . 0.0 113.608 178.866 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.8 m -93.84 145.54 24.53 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.464 0.706 . . . . 0.0 110.004 175.701 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -139.56 158.99 43.19 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.85 2.06 . . . . 0.0 110.281 -178.671 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.9 pp -152.83 167.16 29.97 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.96 0.904 . . . . 0.0 112.558 171.095 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 50.4 t -114.32 144.76 42.73 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.676 1.591 . . . . 0.0 110.935 -178.767 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -147.79 139.04 7.49 Favored Glycine 0 N--CA 1.472 1.094 0 C-N-CA 124.031 0.824 . . . . 0.0 113.906 177.584 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -109.46 159.21 17.23 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.728 1.211 . . . . 0.0 112.387 179.161 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.4 tt -146.68 131.77 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 125.321 1.448 . . . . 0.0 109.355 169.377 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.3 m -67.29 152.33 45.91 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.449 1.1 . . . . 0.0 111.92 -177.905 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 3.7 pp -70.72 -11.5 60.98 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 115.372 1.619 . . . . 0.0 115.372 -170.936 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -74.32 148.03 85.77 Favored Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 123.808 0.843 . . . . 0.0 112.069 174.924 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -67.54 -18.74 48.94 Favored 'Trans proline' 0 CA--C 1.54 0.775 0 C-N-CA 123.189 2.593 . . . . 0.0 113.383 -179.015 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -76.83 -10.15 59.17 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.839 1.256 . . . . 0.0 113.718 176.433 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.25 162.32 20.29 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.931 1.292 . . . . 0.0 114.024 -175.106 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -137.92 157.96 45.33 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.109 1.764 . . . . 0.0 109.434 174.75 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 65.4 mt -72.91 132.55 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 123.386 0.674 . . . . 0.0 110.944 -177.986 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -122.34 135.29 54.69 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.772 2.029 . . . . 0.0 110.093 173.389 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -112.65 148.0 35.56 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.181 0.992 . . . . 0.0 113.524 -167.662 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 69.8 m -84.58 -175.45 5.79 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.428 1.491 . . . . 0.0 111.918 168.867 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -63.35 156.48 25.68 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.121 0.968 . . . . 0.0 110.552 168.924 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -93.84 155.45 17.19 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.17 0.988 . . . . 0.0 111.613 172.855 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -147.79 159.96 43.25 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.141 1.376 . . . . 0.0 112.291 -176.029 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -104.12 138.44 40.61 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.913 1.285 . . . . 0.0 112.046 -175.013 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 46.9 tp -109.91 126.7 54.15 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 125.998 1.719 . . . . 0.0 108.688 169.212 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 70.9 ttt180 -118.34 119.38 34.46 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.975 1.71 . . . . 0.0 109.603 175.531 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 43.8 t -104.09 120.39 54.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 C-N-CA 124.341 1.057 . . . . 0.0 108.582 170.367 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 68.1 p -98.9 150.07 22.29 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.308 1.443 . . . . 0.0 109.727 175.435 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 37.1 mp0 -50.73 150.49 2.83 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.978 1.311 . . . . 0.0 112.867 -177.971 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 57.7 ttp180 -63.15 126.84 28.7 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 124.449 1.099 . . . . 0.0 109.496 -178.11 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.39 147.43 48.52 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.092 0.405 . . . . 0.0 112.092 -170.58 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -70.78 154.31 41.96 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.512 1.125 . . . . 0.0 112.487 175.5 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 . . . . . 0 C--O 1.254 1.298 0 C-N-CA 125.417 1.487 . . . . 0.0 112.372 177.208 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 61.7 tpp . . . . . 0 N--CA 1.489 1.488 0 CA-C-O 118.293 -0.861 . . . . 0.0 110.1 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -74.85 168.2 25.35 Favored 'Trans proline' 0 CA--C 1.545 1.067 0 C-N-CA 123.484 2.789 . . . . 0.0 111.861 177.72 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -52.77 140.33 57.25 Favored 'Trans proline' 0 C--N 1.35 0.652 0 C-N-CA 124.321 3.348 . . . . 0.0 113.422 171.757 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 37.2 p -150.25 153.5 36.3 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.7 1.6 . . . . 0.0 111.067 179.609 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -121.46 134.13 55.07 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.255 1.422 . . . . 0.0 110.117 178.533 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.4 m -140.83 157.45 67.53 Favored Pre-proline 0 N--CA 1.477 0.892 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 179.918 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -70.64 157.87 94.14 Favored 'Cis proline' 0 C--N 1.351 0.662 0 CA-C-N 119.327 0.795 . . . . 0.0 110.887 -8.993 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -57.69 -32.7 67.62 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 172.146 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 50.6 tp -138.93 120.37 14.96 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.531 1.533 . . . . 0.0 109.342 170.733 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 50.6 tp -100.62 127.27 47.07 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.524 1.53 . . . . 0.0 109.24 171.146 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.7 t -111.52 124.61 68.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 124.099 0.96 . . . . 0.0 108.562 171.805 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.1 m -127.58 164.32 28.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 124.493 1.117 . . . . 0.0 111.562 173.959 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 16.8 m -88.33 151.27 22.73 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.681 1.193 . . . . 0.0 110.472 173.662 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.12 120.53 2.45 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.942 1.697 . . . . 0.0 112.563 171.634 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.18 1.08 89.64 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 125.868 1.699 . . . . 0.0 115.408 179.692 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -85.13 157.26 20.73 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 119.65 1.725 . . . . 0.0 111.914 175.744 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -82.54 123.53 29.29 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.696 0.798 . . . . 0.0 110.353 177.548 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -104.55 123.79 48.16 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.667 1.187 . . . . 0.0 110.928 -178.529 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 36.0 m -132.3 126.87 34.37 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.002 0.921 . . . . 0.0 111.516 -175.963 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -100.37 153.98 18.88 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 126.1 1.76 . . . . 0.0 110.837 171.027 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 39.4 m -101.53 128.41 47.79 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 125.266 1.426 . . . . 0.0 108.572 169.759 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 95.6 m -124.67 128.77 49.34 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.606 1.162 . . . . 0.0 109.538 170.603 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.9 m -111.0 127.85 55.66 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.744 0.818 . . . . 0.0 109.884 -173.923 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -146.17 141.98 28.0 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.239 1.016 . . . . 0.0 110.874 174.912 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 68.0 m -92.58 101.42 13.84 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 166.862 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -97.62 156.37 16.55 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.735 0.814 . . . . 0.0 112.97 -171.07 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 44.2 m -57.17 128.79 38.75 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 126.692 1.997 . . . . 0.0 111.507 -173.586 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 16.1 m -68.71 -22.98 64.31 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 -169.877 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -78.71 -57.39 3.78 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.367 1.067 . . . . 0.0 111.04 177.062 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 42.5 p -175.92 152.74 1.26 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.792 1.637 . . . . 0.0 111.849 -173.614 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 49.2 p90 -166.08 169.31 14.66 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.353 1.461 . . . . 0.0 112.051 -171.987 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 24.2 t -125.77 119.93 56.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 125.0 1.32 . . . . 0.0 107.878 168.648 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 59.0 tp -99.43 139.4 35.14 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 124.819 1.247 . . . . 0.0 108.662 169.601 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 9.7 m-80 -133.8 152.8 51.98 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.761 1.224 . . . . 0.0 111.193 -170.809 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 24.0 t90 -128.19 139.41 52.49 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.871 1.268 . . . . 0.0 111.04 175.469 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -135.31 143.41 46.16 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 114.677 1.362 . . . . 0.0 114.677 -170.404 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 55.9 ttp85 -93.14 144.46 25.26 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.913 1.685 . . . . 0.0 107.104 165.614 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 28.9 mtp -96.91 145.95 25.41 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 118.945 0.793 . . . . 0.0 112.244 172.62 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 59.3 m -102.89 158.64 31.35 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 125.029 1.331 . . . . 0.0 111.301 169.809 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_exo -56.6 -30.97 85.36 Favored 'Trans proline' 0 C--N 1.355 0.917 0 C-N-CA 124.405 3.403 . . . . 0.0 115.163 -172.97 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 14.3 m -77.02 11.86 1.62 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.001 1.32 . . . . 0.0 113.655 178.094 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 46.3 t30 69.12 25.4 5.81 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 127.164 2.186 . . . . 0.0 112.445 -176.913 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -92.72 170.51 9.66 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.203 1.001 . . . . 0.0 110.628 172.85 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 9.9 p -134.74 152.55 51.85 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.457 1.503 . . . . 0.0 111.555 -174.722 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 43.4 t0 -136.47 125.77 24.84 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.701 1.601 . . . . 0.0 110.042 -177.823 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 12.7 ttmm -75.05 126.13 30.38 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.235 0.541 . . . . 0.0 110.734 -175.875 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 91.0 mt -95.37 -49.43 5.45 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.248 1.419 . . . . 0.0 111.147 -177.8 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -160.82 176.72 11.16 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.41 1.484 . . . . 0.0 110.445 177.296 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -152.85 166.7 31.46 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.862 1.265 . . . . 0.0 112.043 -174.857 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -137.72 115.27 9.6 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 126.033 1.733 . . . . 0.0 109.117 172.587 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -55.9 157.51 22.1 Favored 'Cis proline' 0 C--N 1.352 0.715 0 CA-C-N 120.289 1.139 . . . . 0.0 113.935 -5.803 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -63.04 120.63 11.79 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 -170.526 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -87.58 -1.82 58.2 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.251 1.42 . . . . 0.0 111.749 167.975 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.38 -17.69 45.39 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.936 2.094 . . . . 0.0 113.574 -176.849 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 20.6 m -70.73 -15.11 62.67 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.589 1.156 . . . . 0.0 113.971 173.935 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -69.98 137.13 87.28 Favored Pre-proline 0 CA--C 1.547 0.834 0 O-C-N 121.166 -0.959 . . . . 0.0 110.363 175.233 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -70.81 134.5 25.89 Favored 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 122.746 2.298 . . . . 0.0 110.621 -176.21 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 103.43 -9.27 53.12 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 125.081 1.324 . . . . 0.0 113.184 -172.743 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 18.2 mm100 -79.03 152.77 30.73 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 118.195 0.998 . . . . 0.0 112.044 171.987 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -127.46 147.67 50.3 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.64 1.576 . . . . 0.0 111.324 177.686 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 25.0 m -71.22 -11.95 61.21 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 -174.34 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -67.52 -17.15 64.55 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 114.271 1.212 . . . . 0.0 114.271 -178.776 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -101.91 127.23 48.84 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.916 1.286 . . . . 0.0 110.118 176.498 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -134.2 143.12 47.67 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.412 1.085 . . . . 0.0 112.197 -171.133 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 26.0 t -126.56 127.7 70.54 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 125.14 1.376 . . . . 0.0 109.232 168.562 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 90.3 m -130.52 137.38 49.7 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.479 1.512 . . . . 0.0 110.779 -174.286 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 65.4 tt0 -86.02 134.73 33.83 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.119 0.968 . . . . 0.0 110.59 172.188 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 65.8 mt -87.13 158.92 52.07 Favored Pre-proline 0 CA--C 1.542 0.635 0 C-N-CA 124.203 1.001 . . . . 0.0 112.064 -179.281 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -63.97 -6.97 12.15 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 123.645 2.897 . . . . 0.0 114.017 173.8 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -64.58 -26.04 68.23 Favored 'General case' 0 CA--C 1.552 1.022 0 CA-C-N 119.559 1.072 . . . . 0.0 112.191 169.094 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 92.98 -34.04 4.75 Favored Glycine 0 CA--C 1.53 1.018 0 C-N-CA 126.556 2.027 . . . . 0.0 113.591 174.637 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 22.9 ptt180 -130.75 73.54 1.55 Allowed 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 122.835 1.302 . . . . 0.0 110.378 171.003 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -175.47 143.94 0.66 Allowed 'General case' 0 C--O 1.237 0.398 0 C-N-CA 127.393 2.277 . . . . 0.0 109.14 -177.663 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -142.51 148.31 37.43 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -168.782 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 10.0 m170 -107.31 134.88 49.73 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.26 1.424 . . . . 0.0 111.621 170.442 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -119.92 121.36 38.84 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 126.192 1.797 . . . . 0.0 107.923 178.002 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 22.7 t -133.78 137.04 44.93 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 116.285 1.958 . . . . 0.0 116.285 -166.721 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 48.4 t -96.58 116.26 38.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 C-N-CA 126.906 2.083 . . . . 0.0 107.318 168.265 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 88.5 t -76.83 127.29 37.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 123.657 0.783 . . . . 0.0 109.026 169.599 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 54.4 ttt85 54.75 71.33 0.54 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.931 1.693 . . . . 0.0 111.551 176.864 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -69.83 129.42 39.51 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.627 0.771 . . . . 0.0 110.98 -177.535 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 37.7 mmm-85 -103.74 161.91 13.53 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 126.019 1.727 . . . . 0.0 110.268 179.492 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 3.2 mmm180 -51.81 -34.28 39.37 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 121.009 -1.057 . . . . 0.0 113.418 -179.628 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -66.89 -19.49 65.74 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.408 1.483 . . . . 0.0 115.001 176.81 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -75.9 -13.7 60.26 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 119.831 1.196 . . . . 0.0 113.144 177.992 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.2 m -62.83 129.16 39.23 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 120.661 -1.275 . . . . 0.0 112.156 179.998 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 161.3 -166.46 35.84 Favored Glycine 0 CA--C 1.529 0.924 0 C-N-CA 124.111 0.863 . . . . 0.0 113.246 -173.583 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.6 m -96.83 144.28 26.94 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.664 1.186 . . . . 0.0 110.833 -177.244 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -143.03 158.29 43.74 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.363 1.865 . . . . 0.0 111.321 -175.553 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.2 pp -158.64 166.53 31.84 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.555 1.142 . . . . 0.0 112.208 174.295 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 71.3 m -113.61 162.12 16.6 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.889 1.275 . . . . 0.0 111.268 177.384 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -156.72 133.89 3.81 Favored Glycine 0 N--CA 1.471 0.977 0 O-C-N 121.529 -0.732 . . . . 0.0 114.12 176.462 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -114.52 147.85 38.79 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.285 1.034 . . . . 0.0 112.685 -178.451 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 16.9 tt -153.96 147.97 13.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.296 1.438 . . . . 0.0 111.035 -179.389 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 66.1 m -77.63 150.73 34.58 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 120.918 -1.114 . . . . 0.0 110.689 169.493 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.86 -4.9 37.72 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 115.413 1.635 . . . . 0.0 115.413 -174.333 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -75.05 147.18 83.3 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 124.68 1.192 . . . . 0.0 111.894 174.134 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -68.77 -17.14 42.31 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 123.434 2.756 . . . . 0.0 113.77 -176.613 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -73.66 -16.14 61.22 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.532 1.133 . . . . 0.0 113.575 176.268 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -71.67 168.1 18.43 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.137 1.375 . . . . 0.0 113.765 -176.052 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.54 149.06 35.24 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.125 1.77 . . . . 0.0 108.664 176.866 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 34.0 mt -75.48 121.61 27.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 123.893 0.877 . . . . 0.0 110.928 -175.123 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 36.6 tptt -81.81 115.31 20.97 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.683 0.793 . . . . 0.0 109.769 168.985 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -108.91 158.87 17.28 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.723 2.009 . . . . 0.0 110.587 174.226 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 5.6 t -143.96 -168.03 2.75 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.369 1.068 . . . . 0.0 112.156 176.384 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 98.7 mt -60.82 117.5 5.48 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.874 1.669 . . . . 0.0 111.884 -172.478 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 20.2 ptp180 -66.32 157.86 30.61 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.656 1.582 . . . . 0.0 113.632 -174.67 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -122.36 165.75 15.79 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 127.038 2.135 . . . . 0.0 111.52 -175.057 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -128.01 143.13 51.07 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.585 1.154 . . . . 0.0 111.885 -177.657 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 56.4 tp -113.27 135.94 53.29 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 126.196 1.798 . . . . 0.0 109.97 172.563 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -126.66 123.23 37.1 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.81 1.644 . . . . 0.0 109.539 169.726 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 46.5 t -103.01 124.35 57.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 107.143 -1.429 . . . . 0.0 107.143 169.275 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 67.5 p -101.3 155.3 18.12 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.313 1.445 . . . . 0.0 110.904 177.25 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -58.75 150.81 22.65 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.752 0.787 . . . . 0.0 112.845 178.645 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -75.57 130.32 38.63 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.323 1.049 . . . . 0.0 109.049 -179.471 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 44.9 ptt85 -66.96 163.04 20.62 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 -174.713 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -76.32 154.37 35.1 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.106 0.962 . . . . 0.0 111.359 168.611 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 . . . . . 0 C--O 1.254 1.325 0 C-N-CA 125.618 1.567 . . . . 0.0 112.391 170.804 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 22.9 mmt . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 118.705 -0.664 . . . . 0.0 111.09 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -58.83 159.26 21.6 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 124.451 3.434 . . . . 0.0 113.257 174.542 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -72.17 159.2 50.41 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 123.506 2.804 . . . . 0.0 111.888 175.656 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 85.5 m -141.42 150.46 42.37 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.272 1.429 . . . . 0.0 110.095 -177.242 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -145.08 114.45 7.11 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.152 1.781 . . . . 0.0 109.755 172.793 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 69.2 m -140.91 160.06 59.81 Favored Pre-proline 0 N--CA 1.479 0.976 0 C-N-CA 124.762 1.225 . . . . 0.0 113.069 -170.895 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -71.21 158.71 94.9 Favored 'Cis proline' 0 C--N 1.353 0.788 0 CA-C-N 120.152 1.09 . . . . 0.0 111.531 -4.261 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.55 -25.21 64.35 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 175.387 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 45.2 tp -142.45 122.55 13.73 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.445 1.498 . . . . 0.0 109.044 169.988 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 61.6 tp -108.74 125.47 51.96 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.21 1.404 . . . . 0.0 108.881 169.75 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 12.8 p -108.79 129.33 63.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 123.877 0.871 . . . . 0.0 109.653 169.629 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 28.5 m -130.23 163.09 36.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 124.952 1.301 . . . . 0.0 111.42 173.07 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 16.3 m -84.77 147.47 26.84 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.079 0.951 . . . . 0.0 109.963 170.223 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 64.7 tt0 -56.43 124.95 19.91 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 124.931 1.292 . . . . 0.0 110.696 173.524 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.91 -2.78 84.47 Favored Glycine 0 CA--C 1.532 1.139 0 C-N-CA 126.085 1.802 . . . . 0.0 114.781 -174.795 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -87.58 160.99 17.98 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 119.35 1.575 . . . . 0.0 111.748 172.263 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -87.05 121.44 29.51 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.328 1.051 . . . . 0.0 110.495 177.331 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -97.61 128.49 44.37 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.393 1.077 . . . . 0.0 110.601 177.481 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 97.0 m -132.68 127.05 33.97 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 119.336 0.971 . . . . 0.0 111.84 176.125 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -100.99 159.48 15.17 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.609 1.964 . . . . 0.0 110.409 169.302 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 59.1 m -103.8 134.28 47.38 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.144 1.378 . . . . 0.0 109.312 171.451 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 3.3 t -137.15 142.27 42.22 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.579 1.152 . . . . 0.0 112.366 177.943 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 90.5 p -147.05 154.18 40.87 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 121.065 -1.022 . . . . 0.0 113.115 -176.877 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -149.4 156.23 41.71 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 126.429 1.892 . . . . 0.0 112.34 -172.467 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.4 t -146.83 135.05 21.68 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.567 1.147 . . . . 0.0 109.259 168.926 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -140.6 134.08 29.99 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.251 1.02 . . . . 0.0 112.119 -169.83 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 13.9 m -63.04 -30.16 71.38 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 125.817 1.647 . . . . 0.0 112.415 177.155 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 12.6 p -69.48 -14.69 63.01 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.546 1.538 . . . . 0.0 114.168 174.222 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 71.92 -46.81 0.65 Allowed 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 128.845 2.858 . . . . 0.0 113.424 174.356 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 70.7 m -104.63 126.0 51.29 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.569 1.548 . . . . 0.0 111.252 178.327 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 55.6 p90 -155.55 157.61 37.11 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.6 1.16 . . . . 0.0 112.134 -174.382 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 48.8 t -95.98 127.86 47.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 125.154 1.381 . . . . 0.0 107.274 169.909 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.0 tt -99.37 119.75 38.47 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 173.277 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 23.2 m-80 -112.79 149.41 33.07 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.14 1.376 . . . . 0.0 111.146 179.349 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 11.5 t90 -119.25 142.1 48.34 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.72 1.208 . . . . 0.0 111.7 175.807 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -137.15 149.12 47.07 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.705 1.202 . . . . 0.0 113.769 -169.976 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 79.0 ttt-85 -108.04 140.28 41.44 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.397 1.479 . . . . 0.0 108.252 167.348 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 29.0 mtp -84.41 145.91 27.94 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.59 0.632 . . . . 0.0 112.35 178.345 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 66.0 m -107.64 153.2 41.57 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 125.266 1.426 . . . . 0.0 112.026 179.912 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -56.0 -30.03 76.34 Favored 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 124.69 3.593 . . . . 0.0 115.202 -177.286 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.3 m -76.98 10.16 2.49 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.843 1.257 . . . . 0.0 113.491 178.844 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 67.96 44.85 1.44 Allowed 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.825 2.05 . . . . 0.0 110.585 -175.223 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -124.09 -172.69 2.59 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.518 1.527 . . . . 0.0 109.946 177.892 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.2 p -146.01 148.13 32.38 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.719 1.608 . . . . 0.0 110.403 -174.333 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -124.69 132.59 53.39 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 124.126 0.97 . . . . 0.0 111.258 173.196 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 29.9 ttmt -76.2 126.0 30.19 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.684 1.193 . . . . 0.0 110.766 -179.41 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 66.3 mt -101.54 -51.98 3.33 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 125.501 1.52 . . . . 0.0 111.75 -170.412 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -160.46 160.86 32.6 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 127.009 2.123 . . . . 0.0 108.767 -171.963 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.57 165.4 32.95 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.65 0.78 . . . . 0.0 111.867 -174.936 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -138.19 115.61 9.31 Favored Pre-proline 0 CA--C 1.545 0.763 0 C-N-CA 124.678 1.191 . . . . 0.0 110.749 171.105 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -62.54 161.33 53.26 Favored 'Cis proline' 0 C--N 1.352 0.724 0 CA-C-N 119.253 0.769 . . . . 0.0 110.941 -11.659 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -68.35 94.45 0.54 Allowed 'General case' 0 CA--C 1.546 0.793 0 CA-C-O 122.082 0.944 . . . . 0.0 112.148 -173.602 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -88.73 -10.74 47.28 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.714 1.606 . . . . 0.0 112.891 174.895 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -75.67 -9.8 58.9 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.459 1.904 . . . . 0.0 113.629 172.501 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.5 t 98.49 154.7 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 130.113 3.365 . . . . 0.0 110.377 -172.671 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -53.64 158.77 2.87 Favored Pre-proline 0 CA--C 1.552 1.025 0 C-N-CA 125.719 1.608 . . . . 0.0 112.432 170.307 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -51.64 144.13 34.63 Favored 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 124.165 3.243 . . . . 0.0 113.912 179.474 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 139.71 -8.31 3.07 Favored Glycine 0 CA--C 1.535 1.314 0 C-N-CA 125.082 1.325 . . . . 0.0 114.774 -175.84 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.427 ' CD ' ' H ' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -92.14 -143.79 0.2 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.363 1.465 . . . . 0.0 108.786 168.995 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 47.2 t0 -75.63 71.55 2.53 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 120.575 -1.328 . . . . 0.0 110.201 168.789 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 19.5 m -60.55 -6.83 1.79 Allowed 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 126.834 2.054 . . . . 0.0 115.624 -171.304 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 48.6 mtm180 -57.74 -36.53 72.19 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.696 1.599 . . . . 0.0 113.388 176.149 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 80.3 m-85 -69.81 125.78 27.75 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.01 1.324 . . . . 0.0 111.24 173.025 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 8.2 tmm_? -144.47 139.9 28.59 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.55 1.54 . . . . 0.0 111.915 -169.623 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 65.2 t -119.31 133.46 66.06 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 C-N-CA 125.122 1.369 . . . . 0.0 110.378 172.462 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 45.2 m -127.16 134.42 50.18 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 125.509 1.523 . . . . 0.0 110.473 177.767 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -84.08 138.04 33.26 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.743 1.217 . . . . 0.0 111.022 175.459 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 45.6 mt -93.73 159.19 35.24 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 124.828 1.251 . . . . 0.0 111.695 177.768 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -65.56 -4.47 9.67 Favored 'Trans proline' 0 CA--C 1.542 0.92 0 C-N-CA 123.538 2.825 . . . . 0.0 114.293 174.976 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -68.23 -13.11 62.0 Favored 'General case' 0 CA--C 1.553 1.058 0 CA-C-N 119.454 1.025 . . . . 0.0 112.948 169.825 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 93.84 -34.12 4.83 Favored Glycine 0 N--CA 1.475 1.272 0 C-N-CA 126.66 2.076 . . . . 0.0 114.889 169.327 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 31.0 ptt-85 -146.12 73.63 1.34 Allowed 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 123.967 1.842 . . . . 0.0 110.138 169.792 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -161.58 141.03 10.12 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 128.872 2.869 . . . . 0.0 106.232 -176.349 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -146.09 148.5 32.7 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 -166.696 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 -100.08 122.33 42.78 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.182 1.393 . . . . 0.0 110.135 168.462 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -105.74 105.81 16.02 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 126.653 1.981 . . . . 0.0 108.291 179.975 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.2 m -114.69 145.6 41.85 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -168.704 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 11.0 t -116.82 106.41 20.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 126.588 1.955 . . . . 0.0 106.37 167.313 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 79.4 t -68.61 127.22 30.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 174.069 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 57.4 ttm-85 53.87 68.14 0.89 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.1 1.36 . . . . 0.0 111.457 170.74 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -70.76 138.21 50.28 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.0 0.92 . . . . 0.0 112.118 -173.883 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 8.7 mpt_? -107.67 158.63 17.11 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 126.028 1.731 . . . . 0.0 109.743 175.211 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 40.1 mtp180 -56.15 -32.27 64.13 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 -172.245 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 5.0 p-10 -64.67 -18.68 65.19 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 114.998 1.481 . . . . 0.0 114.998 175.955 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -71.62 -24.78 61.94 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.085 0.857 . . . . 0.0 112.317 177.169 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 19.3 m -54.71 141.55 31.86 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.254 1.022 . . . . 0.0 112.746 -178.37 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 146.98 -163.77 28.61 Favored Glycine 0 N--CA 1.471 1.029 0 C-N-CA 124.432 1.015 . . . . 0.0 113.083 -174.414 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.3 m -92.0 141.04 29.05 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.406 1.082 . . . . 0.0 110.599 -178.308 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 33.6 m-85 -132.57 159.63 38.92 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.779 2.032 . . . . 0.0 110.942 178.818 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -166.25 155.84 11.76 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.61 1.564 . . . . 0.0 112.033 179.909 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 30.8 m -99.53 159.93 14.66 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.873 0.869 . . . . 0.0 112.036 172.86 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -148.06 122.12 1.47 Allowed Glycine 0 CA--C 1.525 0.713 0 C-N-CA 124.836 1.208 . . . . 0.0 111.954 169.668 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -91.55 156.77 17.43 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.592 0.757 . . . . 0.0 111.437 173.886 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.1 tt -152.99 133.05 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 124.453 1.101 . . . . 0.0 110.526 176.654 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 8.5 m -65.42 161.47 19.78 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.739 1.216 . . . . 0.0 113.464 -175.079 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -60.51 -21.78 62.85 Favored 'General case' 0 CA--C 1.547 0.827 0 N-CA-C 115.573 1.694 . . . . 0.0 115.573 -179.258 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -78.33 143.5 64.69 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 124.318 1.047 . . . . 0.0 112.702 -174.755 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -57.35 -25.6 66.41 Favored 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 123.556 2.837 . . . . 0.0 114.514 173.349 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -81.63 -0.79 44.08 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 125.058 1.343 . . . . 0.0 113.811 179.723 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.43 167.6 10.37 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.917 1.287 . . . . 0.0 114.164 -176.242 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -143.06 153.75 43.26 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 126.508 1.923 . . . . 0.0 108.811 179.717 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 99.1 mt -71.64 123.62 26.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 CA-C-O 121.583 0.706 . . . . 0.0 111.98 -174.793 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.92 99.13 11.91 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.801 1.64 . . . . 0.0 106.83 167.326 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -84.6 137.89 33.03 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.323 0.649 . . . . 0.0 111.187 -171.497 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 8.1 t -94.89 -175.43 3.56 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.537 1.135 . . . . 0.0 113.098 179.613 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 9.8 mp -60.94 149.7 35.64 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.347 1.859 . . . . 0.0 111.285 178.788 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -92.76 141.87 27.97 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.384 1.074 . . . . 0.0 109.808 172.155 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -147.26 164.16 34.08 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.755 1.222 . . . . 0.0 111.839 175.875 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -109.44 139.86 43.9 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.217 1.007 . . . . 0.0 112.671 -170.492 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 64.1 tp -108.48 132.15 54.1 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 125.915 1.686 . . . . 0.0 108.963 168.614 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 62.5 ttm-85 -123.83 115.92 22.11 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.754 1.622 . . . . 0.0 109.702 174.028 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 48.7 t -102.78 113.81 40.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 124.372 1.069 . . . . 0.0 108.75 172.006 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 65.0 p -93.65 146.83 23.54 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.605 1.562 . . . . 0.0 109.885 177.95 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -62.79 148.7 46.08 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 121.413 -0.804 . . . . 0.0 112.91 -175.782 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 45.8 ttt85 -78.36 119.32 21.54 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 124.047 0.939 . . . . 0.0 110.257 -173.943 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 66.6 ttp85 -71.05 138.85 50.16 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.559 0.744 . . . . 0.0 111.578 -175.439 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -81.42 149.42 28.82 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.599 1.16 . . . . 0.0 112.168 175.102 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 . . . . . 0 C--O 1.254 1.291 0 C-N-CA 125.698 1.599 . . . . 0.0 112.624 -177.211 . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 2.1 tmt? . . . . . 0 N--CA 1.489 1.477 0 CA-C-O 118.468 -0.777 . . . . 0.0 110.238 . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -81.81 133.87 8.21 Favored 'Trans proline' 0 CA--C 1.543 0.939 0 C-N-CA 123.439 2.759 . . . . 0.0 110.798 177.461 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -58.08 136.13 72.96 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 123.554 2.836 . . . . 0.0 113.124 173.228 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.8 p -137.14 156.82 47.88 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.134 1.373 . . . . 0.0 112.125 -172.603 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -146.33 120.22 9.33 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.912 1.685 . . . . 0.0 109.159 -178.159 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 80.5 p -140.97 159.37 62.25 Favored Pre-proline 0 CA--C 1.55 0.947 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -169.872 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -69.59 161.46 85.63 Favored 'Cis proline' 0 C--N 1.354 0.833 0 CA-C-N 119.551 0.875 . . . . 0.0 111.501 -6.434 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.48 -24.65 67.91 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 113.169 0.803 . . . . 0.0 113.169 176.052 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 46.7 tp -140.4 120.77 14.01 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.568 1.547 . . . . 0.0 108.761 169.854 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 55.4 tp -105.96 125.79 51.42 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.267 1.427 . . . . 0.0 109.029 170.635 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.4 t -110.27 124.39 66.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 124.082 0.953 . . . . 0.0 108.563 173.041 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.6 m -128.3 164.71 29.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 C-N-CA 124.644 1.178 . . . . 0.0 111.635 174.421 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 18.3 m -90.83 148.8 22.27 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.707 1.203 . . . . 0.0 110.437 173.962 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -53.18 123.68 12.45 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.823 1.249 . . . . 0.0 111.406 176.428 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 89.12 -1.56 82.92 Favored Glycine 0 CA--C 1.533 1.199 0 C-N-CA 125.869 1.7 . . . . 0.0 114.826 -177.298 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -86.72 156.68 19.86 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 119.597 1.698 . . . . 0.0 111.877 173.217 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -83.88 123.68 30.18 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.856 0.862 . . . . 0.0 110.294 175.682 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -101.48 129.15 47.48 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.478 1.111 . . . . 0.0 110.894 179.182 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 65.3 m -132.77 126.61 32.8 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.895 0.878 . . . . 0.0 111.533 -178.573 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -101.68 152.12 21.21 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.729 1.612 . . . . 0.0 110.812 169.747 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.6 m -100.72 126.77 47.29 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.639 1.576 . . . . 0.0 109.236 175.853 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 49.4 t -117.97 138.5 52.13 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.382 1.873 . . . . 0.0 111.124 177.561 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 74.1 m -137.55 126.93 24.82 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.528 -0.733 . . . . 0.0 110.17 176.054 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -120.63 156.16 32.26 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.707 1.603 . . . . 0.0 113.978 175.838 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.1 t -137.65 164.31 29.13 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.52 1.928 . . . . 0.0 107.853 166.85 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -156.87 157.1 34.28 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 -169.364 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 11.5 t -73.75 -32.69 63.96 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.082 1.353 . . . . 0.0 112.157 174.812 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 43.3 m -85.43 165.61 17.05 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.938 1.295 . . . . 0.0 111.912 174.485 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -71.56 -16.58 62.32 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.942 1.697 . . . . 0.0 114.287 -176.703 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 9.2 t -162.84 165.43 25.31 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.456 1.502 . . . . 0.0 111.248 178.529 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 46.1 p90 -158.32 155.5 28.91 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.453 1.501 . . . . 0.0 112.075 -173.723 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 93.8 t -95.9 125.36 48.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 125.119 1.368 . . . . 0.0 107.332 169.378 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 56.8 tp -99.95 136.94 39.11 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.978 0.911 . . . . 0.0 110.29 178.059 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 -127.25 160.29 31.74 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.397 1.479 . . . . 0.0 110.627 -176.58 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 19.0 t90 -126.38 139.79 53.0 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.075 1.35 . . . . 0.0 111.427 179.606 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -136.13 144.52 45.11 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.763 1.225 . . . . 0.0 113.749 -171.82 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 56.8 ttt85 -102.49 140.15 37.14 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.886 1.674 . . . . 0.0 107.789 167.162 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 35.4 mtp -89.64 145.94 24.89 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 118.98 0.809 . . . . 0.0 112.318 176.235 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.1 p -89.16 162.06 38.61 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 123.824 0.849 . . . . 0.0 111.991 172.141 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -67.79 -18.87 47.52 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 122.755 2.303 . . . . 0.0 112.642 172.413 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.6 m -80.8 3.99 20.58 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 124.744 1.218 . . . . 0.0 113.042 170.83 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 63.7 t30 70.97 26.38 3.6 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 127.329 2.252 . . . . 0.0 113.24 178.5 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -96.71 -172.7 2.54 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.408 1.083 . . . . 0.0 109.755 169.705 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.0 p -141.6 145.16 34.71 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.619 1.567 . . . . 0.0 110.698 -174.372 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -124.72 130.58 52.69 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 125.035 1.334 . . . . 0.0 110.776 175.821 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 37.5 tttm -83.77 119.1 24.4 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.61 1.164 . . . . 0.0 111.66 -173.134 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 57.5 mt -93.55 -49.19 6.01 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.559 1.544 . . . . 0.0 112.446 -169.278 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -166.5 176.38 7.39 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.289 1.836 . . . . 0.0 110.546 -173.798 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -158.48 163.47 37.1 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.721 1.209 . . . . 0.0 112.674 -175.142 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -137.62 122.72 12.49 Favored Pre-proline 0 CA--C 1.549 0.904 0 C-N-CA 125.569 1.548 . . . . 0.0 109.802 169.977 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -61.49 156.03 57.44 Favored 'Cis proline' 0 C--N 1.352 0.726 0 CA-C-N 120.056 1.056 . . . . 0.0 111.745 -4.251 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -61.69 109.43 1.21 Allowed 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.734 1.214 . . . . 0.0 113.327 -168.779 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -93.05 35.43 1.06 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.939 1.696 . . . . 0.0 111.517 175.268 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 40.6 ptt180 -60.05 -10.99 4.87 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.541 1.936 . . . . 0.0 115.406 -171.815 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 17.3 m -68.84 -10.06 54.8 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.445 1.498 . . . . 0.0 114.035 172.279 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -59.5 160.73 12.62 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 124.623 1.169 . . . . 0.0 112.99 173.602 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -72.59 159.5 48.71 Favored 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 122.658 2.239 . . . . 0.0 110.519 168.007 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 80.21 52.18 4.67 Favored Glycine 0 N--CA 1.47 0.958 0 C-N-CA 123.546 0.593 . . . . 0.0 111.854 179.506 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 83.7 mt-30 -83.03 57.47 3.93 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.341 1.456 . . . . 0.0 112.24 -170.19 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -81.39 118.61 22.82 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.677 1.191 . . . . 0.0 110.088 172.538 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 58.0 p -72.85 -9.19 58.4 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 -175.959 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 1.7 ptm85 -67.37 -20.6 65.59 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 -178.394 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -101.01 126.25 47.67 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.196 1.398 . . . . 0.0 110.267 179.065 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 79.3 mtm180 -134.25 149.81 50.98 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.705 1.202 . . . . 0.0 111.858 -178.24 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 46.6 t -126.5 130.98 71.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 125.112 1.365 . . . . 0.0 109.334 171.11 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 92.4 m -130.53 132.73 45.74 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.687 1.195 . . . . 0.0 110.233 -179.48 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -80.58 141.74 34.76 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.37 0.668 . . . . 0.0 111.824 173.548 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 26.4 mt -90.36 158.29 43.65 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 124.03 0.932 . . . . 0.0 111.342 173.604 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -66.73 -4.69 11.58 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 123.61 2.873 . . . . 0.0 113.97 174.814 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 23.7 m120 -64.31 -18.99 65.13 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.167 0.987 . . . . 0.0 113.428 172.439 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 95.18 -20.92 46.95 Favored Glycine 0 N--CA 1.474 1.205 0 C-N-CA 125.77 1.652 . . . . 0.0 115.392 169.715 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -154.5 73.53 0.91 Allowed 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.468 1.507 . . . . 0.0 109.914 171.288 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -170.39 136.97 1.39 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 127.707 2.403 . . . . 0.0 107.662 -171.99 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 70.8 m-85 -145.18 145.81 31.5 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.891 0.877 . . . . 0.0 112.916 -168.192 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -101.76 125.83 48.5 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.236 1.415 . . . . 0.0 111.433 169.998 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -104.91 112.96 26.28 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.819 2.048 . . . . 0.0 108.419 174.884 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 67.6 m -122.03 129.18 52.22 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 115.147 1.536 . . . . 0.0 115.147 -167.954 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 44.3 t -96.36 116.49 38.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 125.916 1.687 . . . . 0.0 107.532 168.288 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 85.7 t -78.63 125.84 38.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 124.158 0.983 . . . . 0.0 110.177 176.412 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 51.11 66.71 1.1 Allowed 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 126.218 1.807 . . . . 0.0 112.157 175.456 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.42 130.48 43.19 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.508 1.123 . . . . 0.0 111.572 -173.352 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.03 169.58 8.59 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.952 1.701 . . . . 0.0 110.274 171.706 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 27.7 mtp180 -56.29 -30.71 62.86 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 121.208 -0.932 . . . . 0.0 113.373 -177.098 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 29.7 t30 -60.43 -27.94 67.88 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 124.967 1.307 . . . . 0.0 114.387 172.299 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -75.62 -14.54 60.38 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.289 0.95 . . . . 0.0 113.086 175.536 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 34.2 m -61.63 141.34 57.86 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 120.231 1.378 . . . . 0.0 111.65 177.385 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 150.41 -169.67 30.34 Favored Glycine 0 N--CA 1.473 1.138 0 C-N-CA 124.377 0.989 . . . . 0.0 113.345 -176.997 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.3 m -94.88 142.45 27.45 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.271 1.028 . . . . 0.0 110.517 -178.057 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -138.82 162.51 34.58 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.137 1.775 . . . . 0.0 111.71 -179.144 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -161.75 157.56 24.46 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.578 1.551 . . . . 0.0 111.783 174.183 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 25.9 p -104.68 151.73 23.35 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.456 0.702 . . . . 0.0 111.754 168.834 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -148.47 133.05 4.41 Favored Glycine 0 N--CA 1.471 0.986 0 C-N-CA 124.709 1.147 . . . . 0.0 112.784 -177.836 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -110.57 156.02 21.51 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -176.175 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 19.7 tt -137.89 136.13 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 125.698 1.599 . . . . 0.0 109.921 174.026 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 14.4 t -62.77 157.52 20.97 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.774 0.83 . . . . 0.0 112.953 176.935 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.49 -9.65 50.31 Favored 'General case' 0 CA--C 1.546 0.827 0 N-CA-C 114.274 1.213 . . . . 0.0 114.274 169.95 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -68.56 149.18 98.07 Favored Pre-proline 0 CA--C 1.553 1.078 0 C-N-CA 124.341 1.056 . . . . 0.0 112.428 178.592 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -69.32 -26.13 29.93 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 122.951 2.434 . . . . 0.0 112.812 178.853 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.8 ptmt -86.04 5.22 34.51 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.218 1.407 . . . . 0.0 114.581 178.055 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.41 163.17 18.87 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.799 1.24 . . . . 0.0 114.214 -173.335 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.96 157.25 43.42 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 126.308 1.843 . . . . 0.0 108.648 176.875 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 61.7 mt -78.31 124.38 36.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 123.861 0.865 . . . . 0.0 111.269 -174.482 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 24.1 tptp -94.55 126.93 40.15 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.297 1.439 . . . . 0.0 109.613 168.839 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -84.38 157.02 21.57 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.293 1.037 . . . . 0.0 112.059 175.237 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 97.0 p -108.33 -166.13 1.1 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 125.241 1.416 . . . . 0.0 111.099 168.128 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 11.1 mp -63.16 151.02 41.41 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.347 1.059 . . . . 0.0 111.715 172.661 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -90.69 142.74 27.45 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.075 0.95 . . . . 0.0 109.985 171.542 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -135.0 152.93 52.18 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 125.322 1.449 . . . . 0.0 111.809 178.74 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -104.51 138.87 40.24 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.661 1.184 . . . . 0.0 111.687 -177.9 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 50.9 tp -108.81 129.28 55.39 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 125.905 1.682 . . . . 0.0 109.202 169.348 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 60.6 ttt85 -121.69 120.22 34.07 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.795 1.638 . . . . 0.0 109.71 173.664 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 39.1 t -104.22 118.91 52.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 124.177 0.991 . . . . 0.0 109.045 171.626 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 67.4 p -98.74 154.77 17.74 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 126.114 1.766 . . . . 0.0 110.459 178.266 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -65.85 144.78 56.61 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.674 -0.641 . . . . 0.0 112.21 -177.367 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 35.9 ttt85 -84.34 133.25 34.54 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.577 1.151 . . . . 0.0 109.862 179.169 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 -127.95 153.76 46.34 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.662 1.185 . . . . 0.0 111.669 -177.189 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -74.54 154.37 38.65 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.552 1.141 . . . . 0.0 112.363 174.415 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 . . . . . 0 C--O 1.253 1.258 0 C-N-CA 125.045 1.338 . . . . 0.0 113.277 176.131 . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 33' ' ' MET . . . . . 0.597 ' N ' ' HG ' ' A' ' 57' ' ' SER . 2.3 mpt? . . . . . 0 N--CA 1.488 1.446 0 CA-C-O 118.356 -0.83 . . . . 0.0 110.492 . . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -60.5 149.91 84.15 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 123.535 2.824 . . . . 0.0 112.096 173.229 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -71.13 115.49 4.29 Favored 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 123.743 2.962 . . . . 0.0 110.436 178.924 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.7 t -152.23 156.9 40.63 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.577 0.751 . . . . 0.0 112.802 -170.535 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 82.9 t80 -149.05 117.46 6.49 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.593 2.357 . . . . 0.0 108.647 -176.603 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 91.8 p -140.96 159.35 62.36 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 124.554 1.142 . . . . 0.0 113.558 -169.032 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -70.35 164.98 79.55 Favored 'Cis proline' 0 C--N 1.355 0.893 0 CA-C-N 119.987 1.031 . . . . 0.0 112.221 -2.535 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.05 -24.94 68.15 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 175.573 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 40.2 tp -143.55 119.03 10.32 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 125.772 1.629 . . . . 0.0 108.855 169.847 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 56.6 tp -102.1 124.39 47.63 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.656 1.182 . . . . 0.0 108.859 169.536 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.8 t -110.17 124.51 66.98 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 172.756 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 30.5 m -126.06 163.56 27.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 C-N-CA 124.388 1.075 . . . . 0.0 111.781 172.398 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 35.1 m -92.53 144.95 24.83 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.031 0.932 . . . . 0.0 109.863 171.836 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -49.65 124.59 9.86 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.333 1.453 . . . . 0.0 112.579 -179.262 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 91.52 -3.89 79.26 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 126.052 1.787 . . . . 0.0 114.818 -177.415 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -84.75 157.64 20.97 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.585 1.692 . . . . 0.0 112.088 174.929 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -83.61 117.65 23.3 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.84 0.856 . . . . 0.0 110.478 175.64 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -97.83 114.46 26.51 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.152 0.981 . . . . 0.0 111.134 -177.3 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 30.5 m -117.56 126.5 52.68 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.758 0.823 . . . . 0.0 111.793 -177.164 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -100.89 159.51 15.14 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.527 1.931 . . . . 0.0 109.969 169.385 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 93.3 m -102.36 139.16 38.33 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.346 1.458 . . . . 0.0 108.699 169.669 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 46.8 t -130.35 146.33 51.92 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.707 1.203 . . . . 0.0 111.234 171.062 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 16.0 t -149.54 133.62 17.18 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 121.347 -0.846 . . . . 0.0 111.342 179.044 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 18.5 m-85 -140.95 156.17 46.12 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 127.779 2.432 . . . . 0.0 111.69 -179.103 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.597 ' HG ' ' N ' ' A' ' 33' ' ' MET . 35.3 m -135.97 111.28 9.07 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.13 0.972 . . . . 0.0 110.54 168.44 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 19.3 m120 -95.21 164.26 12.93 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.462 1.105 . . . . 0.0 111.014 172.545 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 19.9 m -65.01 -38.5 91.12 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.391 1.477 . . . . 0.0 111.423 177.968 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 33.5 m -71.28 147.01 48.57 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.857 1.263 . . . . 0.0 110.442 169.407 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -65.36 -32.4 74.02 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.47 1.108 . . . . 0.0 112.447 -178.353 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 66.7 m -123.8 158.58 31.46 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.41 1.484 . . . . 0.0 111.664 174.407 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 44.9 p90 -160.69 165.28 30.79 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.467 1.507 . . . . 0.0 111.437 -174.418 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 22.4 t -96.0 128.04 47.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 171.05 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 18.8 tp -105.12 139.11 40.28 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.911 0.884 . . . . 0.0 110.072 171.726 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 14.8 m-80 -132.94 150.38 52.16 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.582 1.553 . . . . 0.0 110.644 -169.698 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 9.4 t90 -121.71 137.55 54.71 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.201 1.0 . . . . 0.0 111.758 -178.493 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -134.07 144.32 48.56 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.565 1.146 . . . . 0.0 113.155 -175.434 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -104.89 140.08 38.68 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.028 1.331 . . . . 0.0 108.438 168.251 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 27.2 mtp -87.12 141.82 28.38 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 118.717 0.69 . . . . 0.0 111.956 178.879 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 50.2 m -92.81 157.98 38.64 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 124.888 1.275 . . . . 0.0 111.919 176.562 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_exo -55.73 -33.8 88.82 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 123.919 3.079 . . . . 0.0 114.113 176.48 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.7 m -77.03 9.55 2.91 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.182 1.393 . . . . 0.0 113.768 176.932 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 26.8 m120 70.42 20.9 5.85 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 127.336 2.254 . . . . 0.0 113.359 -179.016 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -89.99 -173.73 3.98 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.482 1.113 . . . . 0.0 110.549 170.555 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.9 p -144.15 145.93 32.43 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.779 1.632 . . . . 0.0 110.507 -175.635 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -123.15 132.4 54.06 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.648 1.179 . . . . 0.0 111.192 175.243 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -79.01 126.87 31.26 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.921 0.888 . . . . 0.0 111.382 -177.892 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 59.4 mt -99.75 -45.15 5.84 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.984 1.313 . . . . 0.0 112.472 -169.968 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -173.99 175.9 2.69 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.713 2.405 . . . . 0.0 110.282 -174.102 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.55 168.83 25.19 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.206 1.403 . . . . 0.0 112.379 -178.544 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -144.66 122.29 6.53 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 125.64 1.576 . . . . 0.0 110.042 169.481 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -51.59 145.72 10.07 Favored 'Cis proline' 0 C--N 1.352 0.759 0 CA-C-N 120.435 1.191 . . . . 0.0 112.582 -9.319 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -70.14 117.57 11.86 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 122.441 1.115 . . . . 0.0 113.696 -168.378 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -94.53 9.64 37.79 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.826 2.051 . . . . 0.0 112.284 177.938 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -56.88 -6.07 0.3 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 128.229 2.611 . . . . 0.0 117.012 -169.904 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 12.9 p -74.73 -20.45 59.83 Favored 'General case' 0 CA--C 1.546 0.822 0 O-C-N 120.987 -1.071 . . . . 0.0 112.897 169.078 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -84.41 144.79 43.89 Favored Pre-proline 0 CA--C 1.547 0.83 0 C-N-CA 124.576 1.15 . . . . 0.0 110.597 174.615 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -73.85 156.14 48.36 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 124.022 3.148 . . . . 0.0 113.853 -168.371 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 100.86 -24.88 30.37 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 126.337 1.923 . . . . 0.0 111.57 -178.115 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -82.57 148.22 28.16 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.936 1.294 . . . . 0.0 111.553 -178.707 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -143.0 142.38 31.59 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.588 1.155 . . . . 0.0 112.519 -174.677 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 15.4 m -65.72 -15.5 62.88 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 115.571 1.693 . . . . 0.0 115.571 -172.072 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 44.5 mtp-105 -65.97 -28.84 69.2 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.55 1.068 . . . . 0.0 112.14 171.884 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -92.03 127.88 37.67 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.922 1.289 . . . . 0.0 109.736 175.625 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -131.15 144.16 51.17 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.19 1.396 . . . . 0.0 110.804 -175.867 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 47.8 t -126.57 128.28 71.05 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 124.846 1.258 . . . . 0.0 108.986 176.478 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 88.5 m -125.98 132.31 52.07 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.82 1.248 . . . . 0.0 110.287 -176.939 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -88.13 137.94 31.88 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.024 0.929 . . . . 0.0 110.407 172.735 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 44.2 mt -87.47 158.7 51.31 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 124.745 1.218 . . . . 0.0 111.433 177.669 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -65.42 -2.71 6.46 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 123.529 2.819 . . . . 0.0 114.293 175.85 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -63.52 -26.08 68.54 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 119.643 1.11 . . . . 0.0 112.861 169.735 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 98.61 -22.22 42.05 Favored Glycine 0 N--CA 1.476 1.308 0 C-N-CA 125.696 1.617 . . . . 0.0 114.273 174.579 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -154.48 73.65 0.92 Allowed 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.519 1.528 . . . . 0.0 110.166 169.381 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 17.9 t0 -163.56 141.48 7.6 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 128.919 2.888 . . . . 0.0 106.819 178.486 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -146.42 155.75 42.8 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 -167.188 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 56.7 m170 -116.15 147.61 41.19 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 126.043 1.737 . . . . 0.0 110.955 168.502 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 33.3 mtt -132.94 112.96 12.3 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.622 1.569 . . . . 0.0 109.381 -178.009 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 68.0 m -118.41 126.21 51.59 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 -167.561 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 19.7 t -90.53 108.35 19.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 167.653 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 88.7 t -70.55 125.74 29.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 123.727 0.811 . . . . 0.0 109.389 176.325 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 39.2 ttm180 54.64 63.83 2.01 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.108 1.363 . . . . 0.0 111.035 172.241 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -70.38 137.36 50.44 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.554 0.742 . . . . 0.0 111.476 -171.427 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -114.66 163.44 15.44 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.818 1.647 . . . . 0.0 110.62 -179.542 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 88.1 mtm-85 -52.88 -34.96 57.08 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.867 0.867 . . . . 0.0 112.858 -175.501 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 39.5 t30 -66.13 -16.42 63.94 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.857 1.663 . . . . 0.0 115.238 176.216 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -80.28 -14.1 58.66 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 120.305 1.411 . . . . 0.0 112.989 176.312 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 20.2 m -62.74 138.79 58.6 Favored 'General case' 0 CA--C 1.546 0.806 0 O-C-N 121.015 -1.053 . . . . 0.0 112.706 -177.543 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 150.74 -163.87 29.77 Favored Glycine 0 N--CA 1.472 1.059 0 C-N-CA 124.505 1.05 . . . . 0.0 113.293 -177.762 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.8 m -92.53 138.89 31.12 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.484 1.114 . . . . 0.0 111.277 -177.213 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -134.24 160.43 37.89 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.43 1.892 . . . . 0.0 111.395 178.218 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -157.24 158.13 35.59 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.864 1.266 . . . . 0.0 112.64 173.096 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 45.5 t -109.41 147.61 32.51 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.865 1.666 . . . . 0.0 111.033 -178.68 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -150.66 142.13 9.32 Favored Glycine 0 N--CA 1.471 0.997 0 N-CA-C 114.63 0.612 . . . . 0.0 114.63 179.272 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -115.82 159.25 21.73 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.14 1.376 . . . . 0.0 113.684 -173.933 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 19.9 tt -155.95 136.36 4.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 125.723 1.609 . . . . 0.0 110.568 173.848 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 18.2 m -65.81 161.31 21.25 Favored 'General case' 0 N--CA 1.475 0.787 0 O-C-N 121.282 -0.886 . . . . 0.0 113.115 179.927 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 56.6 mt -70.06 -20.6 63.22 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.731 1.012 . . . . 0.0 113.731 -177.882 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -70.37 146.09 93.87 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 124.35 1.06 . . . . 0.0 112.253 177.4 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -69.65 -16.6 38.1 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 123.296 2.664 . . . . 0.0 113.273 -179.653 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 47.5 mmtm -79.95 -0.27 34.44 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.78 1.232 . . . . 0.0 114.142 177.114 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -77.05 165.22 24.91 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 125.633 1.573 . . . . 0.0 113.78 -178.093 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 27.4 mp0 -138.59 155.83 48.0 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.902 1.681 . . . . 0.0 109.719 174.262 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 32.0 mm -60.48 137.11 23.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 124.421 1.088 . . . . 0.0 111.158 177.879 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.12 137.2 54.91 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.983 1.713 . . . . 0.0 109.54 169.585 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -113.94 153.7 28.83 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.27 1.028 . . . . 0.0 112.863 -169.424 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 80.2 p -104.44 173.31 6.36 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.655 1.582 . . . . 0.0 112.914 174.717 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.83 122.81 18.51 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.532 1.133 . . . . 0.0 110.88 174.416 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.73 151.26 45.59 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.14 0.976 . . . . 0.0 113.227 179.662 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -143.0 164.81 29.06 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.52 1.528 . . . . 0.0 112.913 -178.486 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -102.78 143.13 32.81 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.267 1.427 . . . . 0.0 112.834 -172.737 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 60.7 tp -114.79 132.13 56.57 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 126.343 1.857 . . . . 0.0 108.542 168.075 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 61.9 ttm-85 -126.01 120.22 29.72 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.284 1.433 . . . . 0.0 109.908 174.098 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 41.2 t -104.36 113.09 40.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 124.355 1.062 . . . . 0.0 108.623 170.507 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 71.2 p -93.01 145.31 24.47 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.342 1.457 . . . . 0.0 109.858 178.925 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -66.64 144.91 56.11 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 121.431 0.634 . . . . 0.0 111.959 -178.212 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 55.8 ttm-85 -84.68 121.44 27.67 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 123.878 0.871 . . . . 0.0 110.337 -176.622 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -72.27 161.67 30.53 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.054 0.942 . . . . 0.0 113.402 -178.714 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -74.95 154.41 38.14 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.421 1.088 . . . . 0.0 110.5 167.788 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 . . . . . 0 N--CA 1.483 1.207 0 C-N-CA 126.845 2.058 . . . . 0.0 115.561 177.869 . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 25.2 ptp . . . . . 0 N--CA 1.489 1.479 0 CA-C-O 118.404 -0.807 . . . . 0.0 111.151 . . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -75.59 158.9 39.68 Favored 'Trans proline' 0 CA--C 1.542 0.92 0 C-N-CA 123.343 2.695 . . . . 0.0 111.115 174.356 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -67.96 114.95 3.55 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 123.558 2.839 . . . . 0.0 109.684 174.586 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 27.5 m -134.65 147.96 50.26 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 126.993 2.117 . . . . 0.0 109.117 -172.312 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 43.9 t80 -149.01 121.39 8.45 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.677 1.191 . . . . 0.0 110.484 -176.576 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 58.7 m -140.87 159.89 60.53 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 124.489 1.115 . . . . 0.0 113.026 -169.344 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -70.02 158.85 91.37 Favored 'Cis proline' 0 C--N 1.353 0.807 0 CA-C-N 119.88 0.993 . . . . 0.0 111.482 -5.168 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.56 -30.99 69.02 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 174.476 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 33.4 tp -134.93 123.08 22.83 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 125.44 1.496 . . . . 0.0 108.932 170.403 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 54.7 tp -108.37 124.84 50.99 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.736 1.214 . . . . 0.0 109.256 170.524 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 18.8 t -109.76 124.31 66.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 C-N-CA 123.935 0.894 . . . . 0.0 108.898 173.566 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.6 m -127.64 169.83 18.43 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 C-N-CA 124.897 1.279 . . . . 0.0 111.355 171.924 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 89.5 m -100.0 147.86 25.15 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.771 1.229 . . . . 0.0 110.244 174.757 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -55.32 119.1 5.06 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.676 1.19 . . . . 0.0 112.159 179.808 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.87 -1.16 63.16 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 126.301 1.905 . . . . 0.0 114.709 -176.911 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -90.93 153.73 19.98 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 119.275 1.538 . . . . 0.0 110.924 171.245 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -80.79 139.91 35.77 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 121.875 0.845 . . . . 0.0 111.519 171.919 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -114.65 130.27 56.78 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.246 1.818 . . . . 0.0 110.545 -178.664 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 30.9 m -132.7 124.6 28.49 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.71 0.804 . . . . 0.0 111.618 -176.552 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -101.59 159.57 15.19 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.032 1.733 . . . . 0.0 110.299 169.469 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 25.9 m -112.66 132.02 55.37 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.368 1.467 . . . . 0.0 110.067 175.057 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 35.3 t -114.39 140.82 48.36 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.572 1.549 . . . . 0.0 112.08 171.899 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 17.2 m -134.13 131.85 39.19 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.967 1.707 . . . . 0.0 108.305 176.036 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 42.4 p90 -160.69 156.18 25.07 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 119.919 1.236 . . . . 0.0 113.558 -169.179 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.5 p -83.45 147.69 27.69 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.746 1.218 . . . . 0.0 113.109 173.876 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -163.73 160.32 22.44 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.159 2.184 . . . . 0.0 110.262 174.418 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 80.6 p -68.27 175.25 3.39 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 124.115 0.966 . . . . 0.0 112.932 -173.505 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 20.2 m -70.94 -8.23 51.58 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 172.861 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -93.5 -79.24 0.41 Allowed 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.74 1.216 . . . . 0.0 111.672 -176.015 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.5 t -173.28 167.16 4.82 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.164 1.386 . . . . 0.0 111.396 -169.876 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 55.9 p90 -160.56 163.0 33.07 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.05 1.34 . . . . 0.0 113.501 -170.156 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 62.4 t -107.14 124.2 62.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 125.5 1.52 . . . . 0.0 107.08 167.681 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -99.4 140.78 33.07 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.454 1.502 . . . . 0.0 108.014 170.701 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -136.68 149.42 47.91 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.502 1.521 . . . . 0.0 111.171 175.331 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 22.0 t90 -124.55 138.36 54.33 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.525 1.13 . . . . 0.0 110.73 174.602 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -132.47 147.94 52.38 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 -170.939 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.9 ttt180 -109.26 141.34 41.69 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.792 1.637 . . . . 0.0 108.355 167.242 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 36.2 mtp -86.42 145.89 26.66 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 118.944 0.793 . . . . 0.0 112.462 176.301 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.1 p -88.88 165.2 28.34 Favored Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 123.89 0.876 . . . . 0.0 112.662 174.162 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -58.82 -28.98 88.65 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 123.636 2.891 . . . . 0.0 113.433 170.594 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.4 m -80.36 1.78 27.49 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.896 1.279 . . . . 0.0 113.265 175.939 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 73.61 21.09 2.92 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 127.588 2.355 . . . . 0.0 113.213 -179.649 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -88.38 -172.67 3.87 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.622 0.769 . . . . 0.0 109.575 169.483 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.3 p -140.59 142.86 35.04 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.376 1.47 . . . . 0.0 110.804 -174.84 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -122.86 131.53 53.79 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.505 1.122 . . . . 0.0 110.922 175.442 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 20.8 ttmt -71.9 137.74 47.65 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.873 0.869 . . . . 0.0 110.632 178.385 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 52.8 mt -114.61 -45.99 2.98 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.936 1.695 . . . . 0.0 111.975 -171.944 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -156.51 168.62 26.82 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 126.281 1.832 . . . . 0.0 109.689 179.683 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -156.62 163.68 39.05 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.348 1.059 . . . . 0.0 111.955 -174.801 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -149.2 110.35 3.46 Favored Pre-proline 0 CA--C 1.547 0.835 0 CA-C-O 118.024 -0.988 . . . . 0.0 110.676 174.646 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -51.64 143.82 9.4 Favored 'Cis proline' 0 C--N 1.352 0.734 0 CA-C-N 120.64 1.264 . . . . 0.0 113.623 -4.794 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -75.73 135.1 40.35 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.386 1.075 . . . . 0.0 113.754 -169.239 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 37.2 t0 -104.68 36.29 2.47 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 126.297 1.839 . . . . 0.0 112.374 -168.551 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 45.3 mmm-85 -61.83 -21.95 65.07 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 125.314 1.446 . . . . 0.0 114.74 -170.226 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 16.4 p -78.75 -14.33 59.34 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 113.688 0.996 . . . . 0.0 113.688 177.545 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -98.53 155.36 36.89 Favored Pre-proline 0 CA--C 1.545 0.786 0 C-N-CA 125.036 1.334 . . . . 0.0 110.672 174.531 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -72.55 149.51 49.7 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 123.382 2.721 . . . . 0.0 111.872 -176.337 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 102.41 -21.01 42.62 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 125.643 1.592 . . . . 0.0 112.274 -177.665 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -87.14 73.75 9.73 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 122.312 1.053 . . . . 0.0 111.524 -179.374 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -83.83 145.75 28.49 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.82 1.648 . . . . 0.0 111.789 174.865 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 40.7 m -67.07 -12.87 61.15 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 -171.925 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 44.6 mtp180 -66.54 -27.03 67.43 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.18 0.9 . . . . 0.0 112.627 171.042 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 -95.01 137.48 34.0 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.937 1.295 . . . . 0.0 111.079 178.43 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 30.0 ttp180 -144.46 151.61 39.43 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.234 1.014 . . . . 0.0 111.925 177.421 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -122.79 133.83 67.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 124.962 1.305 . . . . 0.0 110.753 168.869 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.1 m -130.5 130.01 43.63 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.098 1.359 . . . . 0.0 109.871 -173.247 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -79.4 136.38 36.95 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 118.736 0.698 . . . . 0.0 110.778 178.549 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 7.0 mt -79.79 159.9 70.39 Favored Pre-proline 0 CA--C 1.544 0.715 0 CA-C-O 118.92 -0.562 . . . . 0.0 111.652 177.773 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -62.85 -16.74 55.65 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 123.135 2.556 . . . . 0.0 113.646 170.996 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -66.11 -26.06 67.28 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 119.231 0.923 . . . . 0.0 112.439 169.793 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 86.21 -34.11 3.49 Favored Glycine 0 N--CA 1.472 1.066 0 C-N-CA 126.836 2.16 . . . . 0.0 114.393 169.881 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 -111.53 73.65 0.83 Allowed 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.594 1.158 . . . . 0.0 108.194 169.41 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 175.36 141.3 0.05 Allowed 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 128.388 2.675 . . . . 0.0 109.739 -170.606 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -142.33 150.22 40.48 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.453 1.101 . . . . 0.0 112.37 178.931 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 18.2 m170 -98.82 139.24 34.79 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.329 1.452 . . . . 0.0 110.229 167.003 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -115.11 113.07 23.52 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 126.761 2.024 . . . . 0.0 108.058 175.961 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 17.8 m -118.76 128.44 54.49 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 114.331 1.234 . . . . 0.0 114.331 -167.338 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 36.6 t -99.24 117.56 44.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 125.869 1.668 . . . . 0.0 106.947 167.528 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 97.2 t -83.09 126.33 40.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 123.893 0.877 . . . . 0.0 109.96 174.577 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 85.5 mtt85 54.21 66.55 1.2 Allowed 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 126.11 1.764 . . . . 0.0 111.624 176.963 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.96 136.43 53.92 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.487 1.115 . . . . 0.0 111.308 -176.87 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -118.26 165.64 13.57 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 126.9 2.08 . . . . 0.0 110.462 -178.262 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 26.3 mmm180 -52.52 -28.73 21.83 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.348 1.059 . . . . 0.0 113.054 178.231 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -63.66 -24.22 67.7 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 125.66 1.584 . . . . 0.0 114.825 173.228 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -86.08 -17.88 33.9 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 120.147 1.34 . . . . 0.0 113.682 -176.992 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 49.3 m -57.71 133.86 55.72 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 120.779 -1.2 . . . . 0.0 112.681 -178.742 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 153.39 -167.46 31.91 Favored Glycine 0 N--CA 1.473 1.152 0 C-N-CA 124.253 0.93 . . . . 0.0 113.788 -176.073 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.2 m -91.1 143.05 27.1 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 125.162 1.385 . . . . 0.0 110.825 -175.861 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -139.94 157.55 45.5 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 126.462 1.905 . . . . 0.0 111.551 -177.796 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -156.94 149.31 23.18 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.324 1.05 . . . . 0.0 113.269 173.011 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 44.3 t -89.63 152.98 21.1 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.35 1.86 . . . . 0.0 110.884 172.057 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -160.05 141.63 7.6 Favored Glycine 0 N--CA 1.47 0.936 0 O-C-N 121.469 -0.769 . . . . 0.0 113.207 170.214 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -138.13 158.59 44.01 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 118.259 1.029 . . . . 0.0 113.154 -177.419 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 16.7 tt -147.27 134.62 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 C-N-CA 125.364 1.466 . . . . 0.0 110.097 -178.951 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 65.7 m -76.17 158.48 31.65 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 121.62 -0.675 . . . . 0.0 111.795 176.994 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 28.3 mt -73.92 -10.01 59.22 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 -177.264 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.81 143.06 94.53 Favored Pre-proline 0 CA--C 1.551 1.012 0 C-N-CA 124.104 0.962 . . . . 0.0 111.816 173.738 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -67.72 -19.83 47.05 Favored 'Trans proline' 0 CA--C 1.538 0.675 0 C-N-CA 123.313 2.676 . . . . 0.0 113.35 -176.943 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 23.3 ttpp -83.7 -0.39 50.56 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 124.92 1.288 . . . . 0.0 113.572 177.459 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -74.87 149.75 39.43 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.364 1.066 . . . . 0.0 113.39 -178.277 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -128.89 158.29 39.19 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.925 2.09 . . . . 0.0 107.764 169.991 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 35.1 mt -70.94 114.9 9.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 O-C-N 121.487 -0.758 . . . . 0.0 110.43 -179.072 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -77.85 88.51 4.06 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.32 1.448 . . . . 0.0 108.792 169.629 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -78.65 133.71 37.21 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.129 0.972 . . . . 0.0 110.394 176.898 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 45.0 m -83.68 175.53 9.64 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.396 1.078 . . . . 0.0 113.225 179.669 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 84.5 mt -58.56 147.49 32.03 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.188 0.995 . . . . 0.0 111.563 171.682 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -75.51 132.29 40.65 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 123.369 0.668 . . . . 0.0 110.561 173.839 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.9 169.65 9.07 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 126.268 1.827 . . . . 0.0 109.877 170.06 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -133.98 145.09 49.19 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 122.027 0.917 . . . . 0.0 113.021 173.271 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 68.0 tp -103.66 135.11 45.85 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 127.081 2.152 . . . . 0.0 109.687 176.233 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 60.7 ttt85 -125.27 118.09 25.22 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.731 1.612 . . . . 0.0 109.858 172.425 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 53.2 t -98.4 118.81 45.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 C-N-CA 124.062 0.945 . . . . 0.0 108.573 169.057 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 81.7 p -91.53 149.81 21.5 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.411 1.485 . . . . 0.0 109.999 173.438 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -63.16 147.09 51.87 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.276 0.56 . . . . 0.0 112.035 -179.028 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 27.5 ttm180 -70.39 121.33 17.5 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 123.805 0.842 . . . . 0.0 109.93 -176.072 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 67.2 mtt85 -80.64 154.58 27.29 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.065 0.946 . . . . 0.0 112.401 -169.322 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -73.4 154.34 40.06 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.579 1.152 . . . . 0.0 112.508 175.406 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 . . . . . 0 N--CA 1.486 1.367 0 C-N-CA 129.463 3.105 . . . . 0.0 113.236 177.352 . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 33' ' ' MET . . . . . 0.491 ' N ' ' HG ' ' A' ' 57' ' ' SER . 24.2 ptt? . . . . . 0 N--CA 1.49 1.551 0 CA-C-O 118.53 -0.748 . . . . 0.0 111.467 . . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_exo -59.29 146.24 95.34 Favored 'Trans proline' 0 CA--C 1.541 0.856 0 C-N-CA 123.161 2.574 . . . . 0.0 111.853 172.096 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -74.68 145.74 33.17 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 123.035 2.49 . . . . 0.0 110.991 176.319 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 32.1 p -154.62 144.93 22.03 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 125.681 1.592 . . . . 0.0 110.994 -179.945 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.408 ' CE1' ' HB2' ' A' ' 123' ' ' CYS . 3.9 m-85 -121.86 135.67 54.9 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.004 1.322 . . . . 0.0 110.557 175.328 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 95.1 p -140.98 159.04 63.48 Favored Pre-proline 0 CA--C 1.549 0.921 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 173.31 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -72.7 163.72 88.0 Favored 'Cis proline' 0 C--N 1.352 0.737 0 CA-C-N 119.186 0.745 . . . . 0.0 111.411 -11.376 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.7 -33.9 74.82 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 170.432 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 51.7 tp -138.93 123.57 18.53 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.594 1.557 . . . . 0.0 109.269 171.563 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 51.6 tp -105.14 130.78 53.23 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.259 1.424 . . . . 0.0 109.341 170.755 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.4 t -112.06 126.55 69.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.987 0.915 . . . . 0.0 108.658 170.607 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.3 m -129.56 165.98 28.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 124.545 1.138 . . . . 0.0 111.933 173.079 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 20.0 m -86.3 146.5 26.48 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.178 0.991 . . . . 0.0 110.138 169.573 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 58.1 tt0 -55.32 123.59 14.3 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.042 1.337 . . . . 0.0 110.799 173.02 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.0 -0.5 72.77 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 125.5 1.524 . . . . 0.0 114.861 -174.334 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -95.43 158.08 15.61 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 119.644 1.722 . . . . 0.0 112.274 174.522 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 -83.11 116.58 22.39 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.073 0.949 . . . . 0.0 110.747 -179.866 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -98.47 116.12 30.01 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.292 1.037 . . . . 0.0 111.147 -179.793 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 57.1 m -125.28 125.45 43.55 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 118.718 0.69 . . . . 0.0 111.896 -174.609 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -101.06 146.72 27.07 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 126.371 1.868 . . . . 0.0 110.689 171.989 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 31.5 m -93.95 129.34 40.45 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.042 1.337 . . . . 0.0 108.813 171.199 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 69.8 m -130.3 130.24 44.25 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.398 1.079 . . . . 0.0 110.654 172.252 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 68.5 m -117.44 143.4 46.05 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.339 1.456 . . . . 0.0 110.687 -176.316 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -149.59 156.22 41.57 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.248 1.419 . . . . 0.0 113.475 -172.841 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.491 ' HG ' ' N ' ' A' ' 33' ' ' MET . 18.6 m -143.57 133.97 24.71 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.291 1.436 . . . . 0.0 109.834 167.734 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -143.96 166.1 25.89 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.017 1.327 . . . . 0.0 112.324 -177.428 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 25.0 p -73.1 169.62 16.63 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 127.004 2.122 . . . . 0.0 112.219 177.525 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 49.3 m 66.96 10.59 7.78 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 125.565 1.546 . . . . 0.0 114.908 169.242 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 70.29 -0.76 2.71 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 127.725 2.41 . . . . 0.0 114.041 175.621 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 22.8 t -161.17 150.29 16.52 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.592 1.557 . . . . 0.0 111.247 -175.606 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 50.3 p90 -160.17 163.01 34.0 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.505 1.522 . . . . 0.0 111.461 -169.324 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 77.4 t -95.93 127.98 47.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 172.263 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 61.3 tp -106.54 136.16 46.79 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 125.217 1.407 . . . . 0.0 109.751 173.618 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -132.43 153.8 50.48 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.282 1.833 . . . . 0.0 110.528 179.151 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 15.0 t90 -123.52 139.82 53.63 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.659 1.184 . . . . 0.0 111.118 176.081 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 64.4 m-85 -134.28 143.7 47.91 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 114.516 1.302 . . . . 0.0 114.516 -170.824 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 56.9 ttt85 -102.19 143.01 32.53 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.575 1.55 . . . . 0.0 109.229 168.406 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 86.3 mmm -77.46 133.04 38.71 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 118.466 0.575 . . . . 0.0 111.463 174.319 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.5 p -82.45 166.22 37.73 Favored Pre-proline 0 CA--C 1.549 0.914 0 O-C-N 121.557 -0.715 . . . . 0.0 112.555 173.669 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -58.32 -27.99 83.08 Favored 'Trans proline' 0 C--N 1.354 0.856 0 C-N-CA 123.475 2.784 . . . . 0.0 113.662 170.267 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 31.3 m -83.92 2.94 36.21 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.985 1.314 . . . . 0.0 113.189 175.424 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 69.55 26.68 5.02 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 126.721 2.008 . . . . 0.0 112.639 -178.758 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -92.23 -177.47 4.67 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.083 0.953 . . . . 0.0 109.743 169.606 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 8.7 p -127.48 122.51 33.64 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.574 1.55 . . . . 0.0 109.582 -171.981 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -108.22 126.35 52.7 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 124.288 1.035 . . . . 0.0 110.976 -178.094 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -79.22 120.53 23.84 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.632 1.173 . . . . 0.0 111.98 -170.809 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 42.4 mt -97.88 -49.38 4.82 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.654 1.582 . . . . 0.0 111.991 -170.139 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -162.56 169.17 20.68 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.438 1.895 . . . . 0.0 110.145 -173.12 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -157.22 162.65 39.27 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.451 1.101 . . . . 0.0 112.928 -170.155 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -152.32 113.5 2.85 Favored Pre-proline 0 CA--C 1.552 1.038 0 C-N-CA 125.379 1.472 . . . . 0.0 111.114 174.547 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -63.04 160.96 57.85 Favored 'Cis proline' 0 CA--C 1.538 0.686 0 CA-C-N 119.653 0.912 . . . . 0.0 110.287 -12.041 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -74.57 94.6 2.67 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.833 0.825 . . . . 0.0 111.419 -178.233 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -88.91 -0.85 57.75 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.927 1.691 . . . . 0.0 113.773 -179.251 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 50.1 ptt85 -64.09 -35.22 80.04 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.958 1.703 . . . . 0.0 114.217 -173.424 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.0 m 66.44 -45.12 0.43 Allowed 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 128.342 2.657 . . . . 0.0 114.671 -177.048 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 26.0 tp60 -90.0 140.9 27.65 Favored Pre-proline 0 CA--C 1.548 0.873 0 C-N-CA 126.061 1.744 . . . . 0.0 111.085 -176.548 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -89.21 -179.47 2.05 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 124.986 3.791 . . . . 0.0 112.023 175.047 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 112.72 -0.19 26.0 Favored Glycine 0 N--CA 1.471 1.022 0 C-N-CA 125.022 1.296 . . . . 0.0 114.331 173.534 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 22.3 mp0 -76.21 156.67 33.39 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.551 1.14 . . . . 0.0 111.286 175.748 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -68.1 126.81 30.7 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.281 1.032 . . . . 0.0 111.851 178.335 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 16.1 m -68.95 -12.76 61.95 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 -172.877 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 60.6 mtm-85 -65.26 -44.49 87.9 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.649 1.18 . . . . 0.0 112.574 -179.427 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 84.4 m-85 -69.48 130.68 43.16 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.473 1.509 . . . . 0.0 112.026 -179.045 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 31.8 ttp-105 -144.39 141.29 29.57 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 126.041 1.737 . . . . 0.0 111.079 -176.841 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 57.9 t -108.46 127.81 64.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 C-N-CA 125.089 1.356 . . . . 0.0 108.678 169.502 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 6.0 m -123.32 138.65 54.57 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.633 1.573 . . . . 0.0 109.428 -176.323 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.16 141.79 34.44 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.108 0.963 . . . . 0.0 112.679 179.373 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.449 HD23 ' HA ' ' A' ' 106' ' ' PHE . 0.9 OUTLIER -96.76 158.72 33.08 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 126.079 1.752 . . . . 0.0 111.169 -174.75 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -66.98 -11.28 31.64 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 123.627 2.884 . . . . 0.0 114.224 -178.993 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -66.56 -18.25 65.26 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 119.197 0.908 . . . . 0.0 113.248 172.203 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 88.83 -14.69 59.57 Favored Glycine 0 CA--C 1.535 1.3 0 C-N-CA 125.496 1.522 . . . . 0.0 115.323 175.492 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.4 ptp180 -154.51 73.53 0.91 Allowed 'General case' 0 N--CA 1.473 0.694 0 CA-C-O 122.972 1.367 . . . . 0.0 110.581 171.585 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -165.04 143.87 6.59 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 129.254 3.022 . . . . 0.0 106.684 -179.657 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 106' ' ' PHE . . . . . 0.449 ' HA ' HD23 ' A' ' 100' ' ' LEU . 52.0 m-85 -145.32 145.2 31.13 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -167.54 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 7.3 m-70 -109.1 117.6 34.58 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.539 1.536 . . . . 0.0 110.859 170.118 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -100.47 111.16 23.38 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 125.768 1.627 . . . . 0.0 108.206 177.855 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 13.6 t -120.12 130.09 54.46 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 -168.061 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 12.1 t -97.45 100.25 10.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 125.696 1.598 . . . . 0.0 107.045 168.444 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 95.4 t -66.83 130.8 32.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 123.662 0.785 . . . . 0.0 109.907 178.191 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . 0.265 14.6 ptm180 39.7 61.16 1.48 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 127.516 2.326 . . . . 0.0 113.94 -177.123 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.76 140.01 57.71 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.403 1.481 . . . . 0.0 112.605 -171.731 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -104.61 162.02 13.63 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.355 1.462 . . . . 0.0 110.866 -179.478 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 16.4 mmm180 -47.48 -41.12 20.0 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.471 1.108 . . . . 0.0 113.015 178.043 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -65.27 -21.56 66.74 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 125.349 1.46 . . . . 0.0 114.832 177.657 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -75.8 -12.24 60.13 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 119.133 0.879 . . . . 0.0 112.532 176.993 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.5 m -59.09 139.53 56.78 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 120.634 -1.291 . . . . 0.0 111.609 171.794 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 154.76 -168.28 32.79 Favored Glycine 0 N--CA 1.468 0.771 0 C-N-CA 123.927 0.775 . . . . 0.0 113.313 179.428 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.1 m -95.5 144.23 26.16 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.934 1.294 . . . . 0.0 110.191 -179.115 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 -142.82 162.95 34.11 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.605 1.562 . . . . 0.0 112.488 -175.143 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.1 pp -153.48 148.39 26.57 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.845 1.258 . . . . 0.0 111.984 169.154 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 123' ' ' CYS . . . . . 0.408 ' HB2' ' CE1' ' A' ' 37' ' ' PHE . 71.0 m -90.24 153.1 20.74 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.701 1.2 . . . . 0.0 109.652 169.383 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -152.95 134.1 4.31 Favored Glycine 0 N--CA 1.471 1.026 0 O-C-N 121.225 -0.922 . . . . 0.0 113.373 176.45 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -119.75 157.57 28.32 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.347 1.059 . . . . 0.0 112.417 -178.856 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.0 tt -151.41 132.17 4.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 124.868 1.267 . . . . 0.0 110.77 177.939 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 44.9 t -65.21 157.82 27.81 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.894 0.877 . . . . 0.0 112.819 178.251 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 3.8 pp -71.51 -9.48 58.27 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 175.024 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -66.5 146.09 99.02 Favored Pre-proline 0 CA--C 1.552 1.023 0 C-N-CA 124.318 1.047 . . . . 0.0 112.057 175.948 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -68.75 -24.6 34.49 Favored 'Trans proline' 0 CA--C 1.539 0.736 0 C-N-CA 123.092 2.528 . . . . 0.0 113.023 -178.746 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.6 ptmt -83.16 1.37 40.87 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 177.827 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.04 163.75 21.66 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.525 1.13 . . . . 0.0 113.751 -174.837 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 22.3 pt20 -149.68 163.07 38.94 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.53 1.932 . . . . 0.0 109.31 175.32 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 67.1 mt -73.13 119.27 19.74 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 CA-C-O 121.799 0.809 . . . . 0.0 111.174 -173.65 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 25.2 ttmt -88.08 124.73 34.07 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 126.857 2.063 . . . . 0.0 109.536 169.688 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -147.72 158.72 44.15 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.266 1.426 . . . . 0.0 111.292 -179.036 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 17.9 m -117.46 -173.54 2.44 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.674 1.59 . . . . 0.0 111.913 179.855 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 98.5 mt -60.02 143.25 52.33 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.125 0.97 . . . . 0.0 111.836 176.533 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 91.8 mtm-85 -66.52 153.35 43.17 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.91 1.284 . . . . 0.0 113.388 -172.619 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.89 162.56 17.15 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.567 1.947 . . . . 0.0 110.811 175.675 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -130.16 142.74 50.56 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.604 1.162 . . . . 0.0 111.618 -177.2 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 50.9 tp -116.09 133.89 55.54 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 125.978 1.711 . . . . 0.0 110.082 173.41 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 43.5 ttm180 -122.36 117.17 25.41 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.881 1.673 . . . . 0.0 109.31 170.427 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 54.4 t -99.99 119.21 47.74 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 N-CA-C 107.861 -1.162 . . . . 0.0 107.861 169.962 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 72.6 p -98.68 139.9 33.7 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.31 1.444 . . . . 0.0 109.422 177.614 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 4.5 pm0 -62.98 146.04 54.02 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.672 0.789 . . . . 0.0 113.119 -173.041 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 42.9 ttt85 -77.68 117.11 18.77 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 124.132 0.973 . . . . 0.0 110.338 -170.179 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 65.6 ttp85 -72.21 140.33 48.66 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.492 0.717 . . . . 0.0 111.671 -174.619 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -75.22 154.27 37.66 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.644 1.177 . . . . 0.0 112.715 176.253 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 . . . . . 0 C--O 1.254 1.334 0 N-CA-C 114.533 1.309 . . . . 0.0 114.533 177.21 . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 27.1 ttt . . . . . 0 N--CA 1.488 1.461 0 CA-C-O 118.358 -0.829 . . . . 0.0 110.391 . . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_exo -60.3 165.59 10.68 Favored 'Trans proline' 0 CA--C 1.544 1.002 0 C-N-CA 124.025 3.15 . . . . 0.0 113.255 172.41 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -54.29 148.64 40.5 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 123.97 3.113 . . . . 0.0 113.892 174.151 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.8 t -162.5 160.53 26.25 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.052 0.941 . . . . 0.0 112.704 -172.502 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -146.82 118.0 7.81 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.642 1.977 . . . . 0.0 110.007 179.332 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 90.2 p -140.91 163.23 43.92 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 125.027 1.331 . . . . 0.0 113.5 -171.114 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -70.87 165.5 79.6 Favored 'Cis proline' 0 C--N 1.353 0.803 0 CA-C-N 119.932 1.011 . . . . 0.0 111.818 -7.945 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.64 -29.52 70.74 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 172.785 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 51.8 tp -141.31 124.63 16.55 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.65 1.58 . . . . 0.0 109.205 172.356 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 61.3 tp -109.53 126.02 53.12 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.489 1.516 . . . . 0.0 109.012 170.685 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.2 t -110.25 125.14 67.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 123.921 0.888 . . . . 0.0 108.784 173.359 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 33.5 m -130.39 162.8 37.62 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.075 0 C-N-CA 124.667 1.187 . . . . 0.0 112.091 174.053 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 16.5 m -88.36 147.48 24.73 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.533 1.133 . . . . 0.0 110.478 171.874 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -58.61 121.56 11.3 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.884 0.874 . . . . 0.0 112.117 -179.514 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 98.98 -2.94 58.34 Favored Glycine 0 CA--C 1.533 1.162 0 C-N-CA 125.844 1.688 . . . . 0.0 114.54 -173.903 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -87.65 158.16 18.92 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 119.743 1.772 . . . . 0.0 112.443 177.314 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 -77.48 116.04 17.74 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.429 1.092 . . . . 0.0 110.492 170.633 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -102.63 119.62 39.14 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.993 0.917 . . . . 0.0 110.439 178.528 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 54.1 m -128.84 125.37 37.56 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 119.052 0.842 . . . . 0.0 111.711 -175.996 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -98.09 155.69 17.01 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.068 1.747 . . . . 0.0 110.253 169.826 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 56.5 m -107.97 125.7 51.83 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.094 1.358 . . . . 0.0 109.476 177.344 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 16.6 t -118.37 151.64 37.36 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.825 1.25 . . . . 0.0 111.265 170.458 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 24.8 t -147.94 133.28 18.53 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.161 -0.962 . . . . 0.0 111.76 174.186 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 33.2 m-85 -138.42 156.11 47.87 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 127.699 2.399 . . . . 0.0 110.083 170.369 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.3 t -141.25 138.17 33.06 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.429 1.092 . . . . 0.0 110.13 170.58 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 57.4 m-80 -141.13 167.6 21.8 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.571 1.548 . . . . 0.0 110.681 -178.337 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 10.9 t -151.7 167.46 28.11 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.325 1.45 . . . . 0.0 111.318 -179.034 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 55.5 m 69.36 -30.95 0.2 Allowed 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 128.77 2.828 . . . . 0.0 114.173 -174.295 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -143.68 145.5 32.5 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 127.571 2.348 . . . . 0.0 108.319 175.297 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 70.5 m -77.7 169.11 18.86 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.192 0.997 . . . . 0.0 112.488 176.656 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 24.3 p90 -142.71 156.84 45.08 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 113.959 1.096 . . . . 0.0 113.959 -172.743 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 57.3 t -106.37 135.5 44.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 C-N-CA 126.432 1.893 . . . . 0.0 107.662 169.595 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 20.9 tp -104.57 135.96 45.01 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.639 0.775 . . . . 0.0 110.59 171.656 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -127.92 156.06 43.21 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.293 1.437 . . . . 0.0 111.577 -170.035 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 16.2 t90 -129.39 136.03 49.45 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.778 1.231 . . . . 0.0 111.69 -179.607 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -135.84 145.89 46.9 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.399 1.08 . . . . 0.0 112.815 -176.726 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.8 ttt-85 -103.39 141.78 35.36 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.328 1.451 . . . . 0.0 108.85 168.883 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 31.5 mtp -90.29 145.36 25.04 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 118.747 0.703 . . . . 0.0 112.113 178.15 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 70.8 m -95.81 154.86 38.96 Favored Pre-proline 0 CA--C 1.546 0.82 0 C-N-CA 125.175 1.39 . . . . 0.0 111.182 173.526 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -65.44 -23.4 58.2 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 123.175 2.584 . . . . 0.0 113.088 179.435 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 14.6 m -76.96 9.38 2.97 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.087 1.355 . . . . 0.0 113.534 172.398 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . 0.323 0.0 OUTLIER 70.95 20.84 5.19 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 128.891 2.876 . . . . 0.0 114.555 179.545 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -93.66 -174.31 3.43 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.766 1.226 . . . . 0.0 110.949 170.605 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.5 p -144.15 152.56 41.07 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 126.382 1.873 . . . . 0.0 110.317 -175.546 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -128.68 133.15 48.12 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.436 1.094 . . . . 0.0 111.083 172.937 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -78.07 128.3 33.63 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.834 0.854 . . . . 0.0 111.173 -179.95 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 61.4 mt -100.25 -51.02 3.77 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.819 1.248 . . . . 0.0 111.414 -170.342 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -171.09 173.33 5.07 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.582 1.953 . . . . 0.0 110.483 -176.663 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -158.63 161.64 37.2 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.3 1.44 . . . . 0.0 112.077 -176.977 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -141.23 125.5 10.38 Favored Pre-proline 0 CA--C 1.548 0.889 0 C-N-CA 125.148 1.379 . . . . 0.0 110.192 172.549 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -53.9 152.98 16.94 Favored 'Cis proline' 0 C--N 1.351 0.661 0 CA-C-N 120.257 1.128 . . . . 0.0 113.144 -9.025 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -62.78 140.67 58.77 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 -169.805 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 39.4 t0 -85.09 74.41 10.5 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.192 1.397 . . . . 0.0 110.071 173.95 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 20.8 mmm180 -76.15 -8.05 56.16 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -172.677 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 34.4 m -62.51 -32.53 73.47 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 -170.75 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -135.81 153.33 77.15 Favored Pre-proline 0 CA--C 1.546 0.79 0 C-N-CA 127.097 2.159 . . . . 0.0 110.298 172.088 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_exo -58.46 142.99 98.38 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.482 2.788 . . . . 0.0 112.279 171.358 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -80.98 -31.55 34.89 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-O 119.29 -0.728 . . . . 0.0 113.364 179.978 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 73.18 -52.58 0.71 Allowed 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 128.857 2.863 . . . . 0.0 113.144 174.023 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -80.76 61.65 4.5 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 126.301 1.84 . . . . 0.0 110.582 173.526 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 28.7 m -62.05 -6.59 3.05 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.767 1.627 . . . . 0.0 115.157 -172.706 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 8.8 ptp180 -61.55 -26.18 67.78 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 113.666 0.988 . . . . 0.0 113.666 170.587 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -93.35 135.62 34.39 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.165 0.986 . . . . 0.0 111.634 -179.349 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 52.6 mtm180 -139.96 153.12 46.82 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.776 1.23 . . . . 0.0 112.255 177.937 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 63.6 t -126.5 125.55 67.48 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 125.265 1.426 . . . . 0.0 108.094 168.139 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 87.2 m -130.43 126.62 37.46 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.249 1.02 . . . . 0.0 110.235 -178.414 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -80.89 139.87 35.66 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.654 0.781 . . . . 0.0 110.748 174.369 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 16.3 mt -80.85 158.46 70.44 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 124.078 0.951 . . . . 0.0 111.585 177.117 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -65.08 -4.21 8.6 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 123.429 2.752 . . . . 0.0 114.99 179.142 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -70.59 -25.97 63.3 Favored 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 120.562 1.528 . . . . 0.0 112.467 169.908 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 96.58 -3.94 63.6 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 126.214 1.864 . . . . 0.0 114.628 173.701 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 31.2 ptt180 -154.62 73.71 0.91 Allowed 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.937 1.695 . . . . 0.0 110.501 176.17 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -178.02 143.02 0.3 Allowed 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 128.951 2.9 . . . . 0.0 107.905 179.389 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -146.46 136.83 23.82 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.489 0.661 . . . . 0.0 112.757 -168.693 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -98.73 125.55 44.08 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.257 1.423 . . . . 0.0 111.615 170.066 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -104.23 103.24 12.98 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 127.172 2.189 . . . . 0.0 108.39 175.184 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 54.5 p -117.12 132.63 56.62 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 114.842 1.423 . . . . 0.0 114.842 -169.491 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 12.3 t -96.36 111.31 26.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 126.109 1.763 . . . . 0.0 106.961 167.312 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 94.3 t -78.38 127.94 38.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 124.785 1.234 . . . . 0.0 109.302 175.061 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 13.8 tpt180 57.79 54.53 6.14 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.874 1.27 . . . . 0.0 111.092 174.882 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.47 136.85 58.1 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.226 -0.921 . . . . 0.0 113.171 -168.723 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 45.4 mmm-85 -111.38 160.53 16.98 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 125.553 1.541 . . . . 0.0 111.021 -179.248 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 77.3 mtm180 -55.84 -22.59 25.8 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 113.515 0.932 . . . . 0.0 113.515 172.323 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -56.72 -35.51 68.64 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.754 1.621 . . . . 0.0 113.654 168.322 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -83.89 -23.3 31.31 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.862 0.865 . . . . 0.0 112.99 -168.595 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 48.8 m -49.69 139.29 13.03 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.789 1.236 . . . . 0.0 113.119 177.417 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 148.13 -165.87 28.96 Favored Glycine 0 N--CA 1.472 1.033 0 C-N-CA 124.326 0.965 . . . . 0.0 113.359 -176.287 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.2 m -92.35 142.69 27.17 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.982 1.313 . . . . 0.0 110.533 -178.093 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 45.1 m-85 -135.5 161.16 36.27 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.848 1.659 . . . . 0.0 111.91 -179.299 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -148.95 153.28 37.74 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.747 1.219 . . . . 0.0 112.245 172.927 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 49.6 t -101.32 155.4 18.06 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.648 1.579 . . . . 0.0 110.221 169.85 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -163.29 133.6 3.11 Favored Glycine 0 N--CA 1.471 0.999 0 N-CA-C 115.345 0.898 . . . . 0.0 115.345 174.587 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -94.97 157.3 15.96 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.47 1.108 . . . . 0.0 112.76 179.793 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 18.9 tt -152.59 135.41 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 125.065 1.346 . . . . 0.0 110.184 174.673 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 69.7 p -75.53 161.57 29.06 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.68 0.792 . . . . 0.0 113.002 178.2 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.51 -3.39 8.49 Favored 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 115.51 1.67 . . . . 0.0 115.51 178.709 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -73.84 144.18 82.4 Favored Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 124.468 1.107 . . . . 0.0 112.652 -176.306 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -56.53 -32.86 91.14 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 123.362 2.708 . . . . 0.0 113.754 172.502 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.09 4.34 34.61 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 115.046 1.499 . . . . 0.0 115.046 -179.604 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.31 160.32 24.78 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.324 1.05 . . . . 0.0 113.789 -173.833 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -145.34 162.82 36.32 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.821 1.649 . . . . 0.0 110.124 175.017 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 57.8 mt -80.68 119.2 29.78 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 123.62 0.768 . . . . 0.0 111.429 -169.973 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -82.37 93.33 7.16 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.398 1.479 . . . . 0.0 108.303 168.605 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 60.2 mt-10 -79.37 144.49 34.12 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.652 0.781 . . . . 0.0 112.743 -174.658 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 50.2 m -87.37 169.28 12.4 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.814 1.245 . . . . 0.0 113.277 169.776 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 94.2 mt -65.65 150.62 48.16 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.574 0.75 . . . . 0.0 109.888 168.003 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? -76.77 148.23 36.79 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.42 0.688 . . . . 0.0 112.373 -172.531 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -117.95 166.35 12.61 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.429 1.891 . . . . 0.0 110.596 170.093 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -126.36 139.02 53.61 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.656 1.182 . . . . 0.0 111.061 176.84 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 63.7 tp -106.8 131.37 53.99 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.45 1.5 . . . . 0.0 109.531 169.82 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -121.7 109.54 14.85 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.322 1.449 . . . . 0.0 109.199 170.302 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 24.1 t -95.95 114.36 32.48 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 169.979 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 68.9 p -95.73 146.14 24.75 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.452 1.501 . . . . 0.0 109.612 -179.787 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -63.15 148.34 48.26 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 121.627 0.727 . . . . 0.0 112.539 -175.968 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 34.2 ttm180 -75.37 119.74 19.87 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 124.156 0.982 . . . . 0.0 110.02 -175.551 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 31.1 ttp180 -72.17 149.17 44.92 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.416 0.687 . . . . 0.0 111.898 -175.429 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -66.37 154.31 40.43 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.692 0.797 . . . . 0.0 110.416 167.301 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 . . . . . 0 C--O 1.252 1.229 0 CA-C-O 117.669 -1.157 . . . . 0.0 113.454 -177.1 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 48.4 m . . . . . 0 N--CA 1.469 0.509 0 CA-C-O 121.05 0.452 . . . . 0.0 110.063 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -147.0 119.71 8.59 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.894 1.677 . . . . 0.0 109.385 178.026 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 88.3 p -140.85 159.13 63.47 Favored Pre-proline 0 CA--C 1.548 0.904 0 N-CA-C 113.831 1.048 . . . . 0.0 113.831 -168.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -70.06 160.75 88.38 Favored 'Cis proline' 0 C--N 1.355 0.893 0 CA-C-N 119.33 0.796 . . . . 0.0 111.513 -5.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.38 -20.52 66.42 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 176.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 36.5 tp -141.45 116.89 10.18 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 125.43 1.492 . . . . 0.0 108.819 169.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 61.2 tp -104.71 121.81 44.37 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.282 1.433 . . . . 0.0 108.856 170.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 24.0 t -110.67 122.08 64.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 124.251 1.02 . . . . 0.0 108.311 174.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 27.8 m -133.01 167.67 26.1 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 C-N-CA 124.849 1.26 . . . . 0.0 111.777 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.3 m -93.7 150.97 19.97 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.0 1.32 . . . . 0.0 110.66 174.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -46.5 125.67 7.24 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.71 1.204 . . . . 0.0 111.703 168.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.96 -1.11 82.93 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 125.906 1.717 . . . . 0.0 114.813 -179.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -74.67 151.82 39.22 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 119.801 1.801 . . . . 0.0 112.65 173.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 68.0 m-20 -86.64 88.19 7.61 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.2 1.0 . . . . 0.0 109.188 171.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -77.08 114.42 15.86 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.723 0.809 . . . . 0.0 112.351 -167.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 53.0 m -116.27 130.58 56.85 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -171.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -108.57 159.6 16.58 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 127.056 2.142 . . . . 0.0 110.027 168.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 87.9 m -112.97 126.34 55.38 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.375 1.07 . . . . 0.0 110.542 175.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 29.9 m -98.31 148.88 23.2 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.152 0.981 . . . . 0.0 110.215 167.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 39.3 t -139.06 127.4 22.81 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.327 1.051 . . . . 0.0 109.443 172.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 . . . . . 0 N--CA 1.467 0.397 0 C-N-CA 124.861 1.264 . . . . 0.0 112.411 -173.089 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 52.4 p90 . . . . . 0 CA--C 1.541 0.63 0 CA-C-O 120.851 0.358 . . . . 0.0 111.836 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 45.6 t -95.9 132.89 38.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 125.326 1.45 . . . . 0.0 107.765 169.098 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 10.7 tp -99.41 142.43 30.9 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.418 1.487 . . . . 0.0 108.008 168.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -145.56 158.97 43.77 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.409 1.084 . . . . 0.0 113.191 -176.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 16.1 t90 -134.43 141.04 46.68 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.438 1.095 . . . . 0.0 112.512 -170.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -136.92 147.99 46.73 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -172.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 55.5 ttt85 -99.78 129.99 45.94 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 166.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 24.7 tpp -98.49 127.31 44.37 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.258 1.823 . . . . 0.0 109.382 179.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 44.9 m -90.84 160.59 37.91 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 125.469 1.508 . . . . 0.0 113.052 -174.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -67.44 -18.7 49.53 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 123.263 2.642 . . . . 0.0 112.827 173.024 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 42.5 p -76.92 -3.78 40.5 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.657 1.583 . . . . 0.0 113.367 169.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 32.0 m-80 73.77 20.8 2.88 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 128.287 2.635 . . . . 0.0 113.464 179.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.3 pp0? -97.75 169.59 9.57 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.818 0.847 . . . . 0.0 111.497 169.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.6 p -130.16 137.34 50.06 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.181 1.393 . . . . 0.0 110.395 -176.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -118.65 131.53 56.17 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.825 1.25 . . . . 0.0 111.219 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 76.9 tttt -75.93 132.44 40.26 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.73 1.212 . . . . 0.0 111.323 -175.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 76.1 mt -111.48 -47.14 3.2 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.689 1.196 . . . . 0.0 112.435 -170.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -167.74 169.72 11.48 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.607 1.563 . . . . 0.0 110.938 -175.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -158.72 159.39 35.19 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.078 1.351 . . . . 0.0 112.501 -177.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -145.78 118.26 5.15 Favored Pre-proline 0 CA--C 1.548 0.9 0 C-N-CA 125.676 1.591 . . . . 0.0 110.866 175.402 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo . . . . . 0 C--N 1.351 0.676 0 CA-C-N 119.997 1.035 . . . . 0.0 112.592 -12.427 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 41.0 mtm180 . . . . . 0 N--CA 1.471 0.602 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -67.61 111.28 4.09 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.397 1.079 . . . . 0.0 110.038 171.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 44.3 ttp85 -120.5 139.8 52.36 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.351 1.86 . . . . 0.0 111.436 -173.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 8.6 t -109.82 131.23 61.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 125.021 1.328 . . . . 0.0 108.845 168.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 73.7 m -130.12 135.73 48.53 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.326 1.05 . . . . 0.0 109.731 172.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -92.7 126.97 38.02 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.047 1.339 . . . . 0.0 109.464 -176.025 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 86.6 mt -90.66 151.48 43.94 Favored Pre-proline 0 N--CA 1.472 0.662 0 C-N-CA 123.837 0.855 . . . . 0.0 112.968 -174.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -64.62 -2.41 5.18 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 123.783 2.989 . . . . 0.0 114.058 176.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -64.92 -25.97 68.11 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 119.572 1.078 . . . . 0.0 112.648 169.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 95.57 -34.09 5.08 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 126.209 1.861 . . . . 0.0 114.016 176.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 46.2 mtm105 -138.32 73.64 1.45 Allowed 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.117 1.367 . . . . 0.0 109.615 169.359 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -165.11 140.38 5.26 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 127.77 2.428 . . . . 0.0 107.132 177.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -143.7 134.85 25.68 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 -167.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.4 t-160 -96.16 113.41 25.01 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 127.452 2.301 . . . . 0.0 110.341 -177.094 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 24.9 mmt -107.7 105.64 15.59 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.875 1.67 . . . . 0.0 109.782 179.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 8.2 t -116.48 125.27 51.72 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -169.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 21.4 t -87.93 88.8 2.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 N-CA-C 106.036 -1.838 . . . . 0.0 106.036 167.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 87.7 t -65.79 119.37 10.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 178.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 62.6 72.29 0.5 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.804 1.641 . . . . 0.0 111.308 -177.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -80.39 139.2 36.63 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.31 1.044 . . . . 0.0 112.088 178.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -112.07 170.05 8.42 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.976 1.71 . . . . 0.0 109.847 175.122 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 27.7 mtp180 -56.23 -34.98 66.84 Favored 'General case' 0 N--CA 1.48 1.066 0 O-C-N 120.86 -1.15 . . . . 0.0 113.436 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 23.7 p30 -63.96 -18.72 64.55 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 115.161 1.541 . . . . 0.0 115.161 175.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -80.56 -7.35 59.21 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.071 0.948 . . . . 0.0 112.656 174.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.4 m -61.85 134.89 57.27 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.086 -1.634 . . . . 0.0 111.11 171.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 159.96 -169.2 35.85 Favored Glycine 0 N--CA 1.471 0.979 0 C-N-CA 124.334 0.969 . . . . 0.0 113.315 -177.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 7.7 m -91.84 142.71 27.28 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.349 1.06 . . . . 0.0 110.319 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -138.98 155.82 47.71 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.539 1.536 . . . . 0.0 111.967 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -159.55 154.56 24.9 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.188 1.395 . . . . 0.0 112.877 178.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 3.3 t -107.91 167.01 10.28 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.091 1.756 . . . . 0.0 111.342 -173.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -159.76 168.79 35.63 Favored Glycine 0 CA--C 1.527 0.818 0 O-C-N 121.196 -0.94 . . . . 0.0 114.208 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -143.9 155.59 44.14 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.954 1.302 . . . . 0.0 112.152 174.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.8 tt -155.68 138.05 6.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 125.652 1.581 . . . . 0.0 110.888 178.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 4.8 m -64.51 161.52 17.14 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.458 1.103 . . . . 0.0 113.067 179.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 43.6 mt -74.24 -16.79 60.94 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 -178.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -69.37 150.11 97.16 Favored Pre-proline 0 CA--C 1.552 1.027 0 C-N-CA 124.619 1.167 . . . . 0.0 112.642 178.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.59 -20.93 35.01 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 123.106 2.537 . . . . 0.0 113.1 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -82.93 0.84 42.53 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 124.784 1.234 . . . . 0.0 113.964 178.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.68 168.52 13.0 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.167 1.387 . . . . 0.0 113.83 -176.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -147.28 156.29 42.8 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.859 1.663 . . . . 0.0 110.038 175.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 52.8 mt -81.57 127.03 39.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 123.082 0.553 . . . . 0.0 111.303 -171.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -95.09 114.49 26.3 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.251 1.82 . . . . 0.0 108.17 168.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -94.52 150.43 20.26 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.46 1.104 . . . . 0.0 111.866 -176.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 60.2 p -85.59 176.64 8.08 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.777 0.831 . . . . 0.0 112.498 169.05 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -69.7 159.88 32.68 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 121.676 -0.64 . . . . 0.0 109.988 165.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -93.44 159.85 15.07 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 -176.2 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -140.65 163.87 31.72 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.412 1.885 . . . . 0.0 111.827 178.161 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -105.28 138.88 40.78 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.105 1.362 . . . . 0.0 112.199 177.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 42.7 tp -108.52 131.37 54.9 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 126.343 1.857 . . . . 0.0 107.652 167.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 30.4 ttm180 -133.78 113.23 12.07 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 124.456 1.102 . . . . 0.0 109.532 -177.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 30.8 t -107.08 112.81 41.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 C-N-CA 124.394 1.078 . . . . 0.0 109.301 -175.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 72.7 p -93.44 160.43 14.81 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 126.622 1.969 . . . . 0.0 111.177 -176.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -62.5 142.91 57.71 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.857 0.863 . . . . 0.0 113.226 -172.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? . . . . . 0 N--CA 1.467 0.424 0 C-N-CA 124.473 1.109 . . . . 0.0 108.747 176.271 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 58.7 m . . . . . 0 N--CA 1.468 0.471 0 CA-C-O 121.222 0.534 . . . . 0.0 110.504 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 93.9 t80 -140.37 116.95 10.83 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 126.972 2.109 . . . . 0.0 108.214 174.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 38.1 m -140.83 160.95 56.64 Favored Pre-proline 0 N--CA 1.479 0.983 0 C-N-CA 124.545 1.138 . . . . 0.0 113.494 -168.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -68.53 156.88 88.86 Favored 'Cis proline' 0 C--N 1.355 0.897 0 CA-C-N 119.982 1.029 . . . . 0.0 111.751 -2.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.33 -28.07 64.72 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.802 0.841 . . . . 0.0 113.074 175.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -134.96 118.13 16.53 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 126.224 1.81 . . . . 0.0 109.187 173.157 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 51.7 tp -109.1 122.3 47.0 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.963 0.905 . . . . 0.0 109.761 171.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 32.2 t -106.84 122.92 61.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 124.132 0.973 . . . . 0.0 109.269 175.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.0 m -128.98 172.34 15.5 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 C-N-CA 125.04 1.336 . . . . 0.0 112.036 170.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 31.9 m -99.14 151.82 20.56 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.812 1.645 . . . . 0.0 110.693 177.195 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -47.19 122.07 4.25 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.998 1.319 . . . . 0.0 112.013 169.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 85.79 -1.85 87.95 Favored Glycine 0 CA--C 1.532 1.123 0 C-N-CA 125.736 1.636 . . . . 0.0 114.576 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 39.4 t0 -87.09 157.41 19.41 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.245 1.523 . . . . 0.0 111.393 175.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -84.08 150.62 25.45 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 121.903 0.859 . . . . 0.0 111.302 169.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -132.41 131.25 41.6 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.267 1.827 . . . . 0.0 110.03 -175.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 89.8 m -131.58 127.05 36.33 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.286 0.948 . . . . 0.0 111.82 179.167 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -100.11 159.54 15.02 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.002 1.721 . . . . 0.0 110.516 169.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 58.8 m -110.32 132.5 54.12 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.661 1.584 . . . . 0.0 109.88 174.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 39.5 t -116.73 144.1 44.86 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.991 1.716 . . . . 0.0 112.003 173.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 80.9 p -151.41 140.51 21.18 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.713 0.805 . . . . 0.0 112.115 171.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 . . . . . 0 CA--C 1.539 0.52 0 C-N-CA 126.49 1.916 . . . . 0.0 112.754 -174.726 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 54.2 p90 . . . . . 0 CA--C 1.538 0.481 0 CA-C-O 121.159 0.504 . . . . 0.0 111.999 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.3 t -96.01 135.76 29.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 125.594 1.557 . . . . 0.0 107.646 169.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -119.41 129.23 54.68 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.169 1.388 . . . . 0.0 108.841 -175.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -130.94 155.72 46.31 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.282 1.433 . . . . 0.0 113.144 -168.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 18.2 t90 -123.32 139.09 54.39 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.662 1.185 . . . . 0.0 112.257 179.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -133.07 147.66 52.18 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.214 1.406 . . . . 0.0 113.665 -173.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 51.2 ttp180 -110.28 141.11 43.73 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 127.419 2.288 . . . . 0.0 108.567 169.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 38.2 mtp -92.94 145.87 24.05 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.252 0.933 . . . . 0.0 112.155 178.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 24.0 p -90.85 165.54 21.87 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 123.626 0.77 . . . . 0.0 112.983 176.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.01 -29.04 89.59 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 123.589 2.859 . . . . 0.0 113.358 169.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 36.1 m -83.39 12.46 5.45 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.195 1.398 . . . . 0.0 112.89 174.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 63.4 t30 63.44 23.56 13.74 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.554 1.941 . . . . 0.0 113.353 178.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 46.4 mm-40 -89.7 -172.73 3.67 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.483 0.713 . . . . 0.0 109.798 170.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.4 p -137.58 143.5 41.55 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.347 1.459 . . . . 0.0 110.902 -176.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -123.73 129.77 51.61 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 126.572 1.949 . . . . 0.0 109.775 -178.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 74.3 tttt -86.6 119.66 27.08 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.604 1.162 . . . . 0.0 110.962 -171.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 65.9 mt -95.04 -51.07 4.81 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.696 1.199 . . . . 0.0 112.381 -168.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -167.37 171.72 10.34 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.321 1.448 . . . . 0.0 111.564 -174.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -150.09 158.36 44.08 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.104 1.362 . . . . 0.0 113.112 -169.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -137.26 136.94 21.33 Favored Pre-proline 0 CA--C 1.548 0.895 0 C-N-CA 125.687 1.595 . . . . 0.0 110.203 169.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo . . . . . 0 C--N 1.352 0.75 0 CA-C-N 120.279 1.136 . . . . 0.0 112.089 -8.566 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.3 ptp85 . . . . . 0 N--CA 1.478 0.957 0 N-CA-C 115.247 1.573 . . . . 0.0 115.247 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -111.88 140.48 46.5 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.714 1.606 . . . . 0.0 111.138 177.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 21.2 ttt-85 -144.4 143.72 31.06 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.832 0.853 . . . . 0.0 113.024 174.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 60.1 t -111.75 127.15 69.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 125.154 1.381 . . . . 0.0 107.704 167.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 76.3 m -130.55 129.55 42.96 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.09 0.956 . . . . 0.0 109.954 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -80.27 139.74 36.52 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.49 0.716 . . . . 0.0 110.978 176.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 30.6 mt -84.56 160.38 56.52 Favored Pre-proline 0 CA--C 1.545 0.766 0 C-N-CA 124.906 1.282 . . . . 0.0 111.669 176.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -62.32 -5.07 6.11 Favored 'Trans proline' 0 CA--C 1.543 0.931 0 C-N-CA 123.542 2.828 . . . . 0.0 114.704 174.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -62.64 -26.13 68.47 Favored 'General case' 0 CA--C 1.551 1.019 0 CA-C-N 119.569 1.077 . . . . 0.0 112.746 169.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 94.08 -17.06 59.56 Favored Glycine 0 N--CA 1.475 1.274 0 C-N-CA 125.59 1.567 . . . . 0.0 114.692 173.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 11.0 ptp180 -154.5 73.61 0.91 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.477 1.511 . . . . 0.0 109.839 169.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -166.44 140.6 4.19 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 128.652 2.781 . . . . 0.0 107.003 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -141.16 143.04 34.02 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 -166.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 17.1 m170 -105.55 132.84 51.21 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.524 1.529 . . . . 0.0 111.711 169.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -112.73 101.82 9.9 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 127.154 2.182 . . . . 0.0 109.298 -178.023 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 60.6 m -109.23 124.12 50.35 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 -169.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 37.2 t -93.53 125.99 46.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 126.278 1.831 . . . . 0.0 106.401 167.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 57.9 t -96.57 126.57 49.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 124.069 0.948 . . . . 0.0 109.408 171.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 67.1 ttt180 58.32 66.15 1.15 Allowed 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.778 1.631 . . . . 0.0 111.826 174.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -72.37 135.54 45.89 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 121.351 -0.843 . . . . 0.0 111.798 -178.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -111.49 164.86 12.52 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.93 1.692 . . . . 0.0 110.202 174.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 31.0 mtp180 -56.88 -32.99 66.41 Favored 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -171.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -64.97 -16.11 62.99 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 175.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 65.5 m-20 -79.73 -13.52 59.39 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 119.329 0.968 . . . . 0.0 112.8 173.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 20.4 m -63.45 129.23 39.36 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 120.868 -1.145 . . . . 0.0 111.566 177.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 158.8 -169.04 35.07 Favored Glycine 0 N--CA 1.47 0.908 0 C-N-CA 124.183 0.896 . . . . 0.0 113.286 -172.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.4 m -92.79 143.27 26.45 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.727 1.211 . . . . 0.0 111.267 -173.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -141.73 157.19 45.35 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.542 1.937 . . . . 0.0 111.267 -177.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -160.53 159.93 31.29 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.855 1.262 . . . . 0.0 113.617 177.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 39.1 t -103.07 149.47 24.56 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.911 1.685 . . . . 0.0 111.57 177.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -144.57 152.64 24.55 Favored Glycine 0 N--CA 1.471 1.015 0 C-N-CA 124.688 1.137 . . . . 0.0 113.182 175.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -132.39 154.63 49.62 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.629 1.171 . . . . 0.0 112.775 -176.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.3 tt -153.31 135.41 6.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 125.104 1.361 . . . . 0.0 110.995 177.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 12.6 m -67.98 158.28 33.17 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 121.099 -1.001 . . . . 0.0 112.498 177.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.7 -9.18 56.6 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 115.689 1.737 . . . . 0.0 115.689 -177.247 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -78.38 144.16 65.67 Favored Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 124.241 1.016 . . . . 0.0 112.281 -178.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -55.56 -29.04 68.01 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 123.748 2.965 . . . . 0.0 114.858 177.22 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -76.99 -5.99 50.85 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 115.056 1.502 . . . . 0.0 115.056 179.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.41 164.2 23.54 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.519 1.127 . . . . 0.0 113.365 -176.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -144.59 161.34 39.37 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.674 1.589 . . . . 0.0 110.295 173.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 56.8 mt -78.98 118.17 25.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 123.65 0.78 . . . . 0.0 111.158 -172.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 59.0 tttp -89.62 137.53 32.25 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.719 1.608 . . . . 0.0 109.214 168.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -115.29 152.75 32.18 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.448 1.099 . . . . 0.0 112.147 -173.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 78.3 p -97.59 172.55 7.65 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.077 1.351 . . . . 0.0 114.118 177.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 14.4 tp -69.99 119.8 14.75 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.144 1.378 . . . . 0.0 108.607 169.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 34.8 ptt-85 -71.35 163.93 26.72 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.101 1.36 . . . . 0.0 113.879 -175.041 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -142.64 169.65 17.18 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.807 2.043 . . . . 0.0 111.234 179.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -117.65 146.16 43.87 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 114.055 1.131 . . . . 0.0 114.055 174.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 66.8 tp -100.21 137.11 39.1 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 127.112 2.165 . . . . 0.0 108.875 169.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 29.3 ttm180 -132.02 117.56 18.55 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.293 1.437 . . . . 0.0 109.964 178.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 40.6 t -106.46 113.21 42.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 125.226 1.41 . . . . 0.0 108.904 178.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 73.8 p -95.01 160.69 14.46 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.824 1.65 . . . . 0.0 111.47 -178.349 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -57.74 144.9 36.46 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.732 1.213 . . . . 0.0 113.686 -173.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 69.7 ttp85 . . . . . 0 C--O 1.236 0.368 0 C-N-CA 124.278 1.031 . . . . 0.0 109.607 179.38 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.1 t . . . . . 0 N--CA 1.476 0.834 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -152.78 119.88 5.84 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.66 1.984 . . . . 0.0 110.658 175.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 94.9 p -140.93 164.19 37.72 Favored Pre-proline 0 CA--C 1.553 1.075 0 C-N-CA 125.446 1.498 . . . . 0.0 112.755 -172.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -70.24 170.65 59.52 Favored 'Cis proline' 0 C--N 1.355 0.873 0 CA-C-N 120.629 1.26 . . . . 0.0 112.396 -2.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.04 -32.94 74.42 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 171.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 49.1 tp -144.92 124.69 13.36 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.559 1.544 . . . . 0.0 109.586 171.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 62.1 tp -102.18 132.75 47.9 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.975 1.31 . . . . 0.0 108.888 169.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 24.7 t -112.65 127.29 69.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 124.072 0.949 . . . . 0.0 108.466 171.037 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 33.2 m -131.4 166.26 29.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 124.624 1.17 . . . . 0.0 111.708 175.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 25.4 m -90.5 148.91 22.43 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.258 1.023 . . . . 0.0 110.229 173.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -59.13 116.05 3.59 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.544 1.538 . . . . 0.0 111.357 176.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.17 5.47 65.7 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 126.385 1.945 . . . . 0.0 114.765 -174.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -92.05 154.78 18.54 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.355 1.578 . . . . 0.0 112.132 173.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -71.08 120.44 16.65 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.455 1.102 . . . . 0.0 110.753 173.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -97.9 128.09 44.27 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 117.867 -1.063 . . . . 0.0 110.076 174.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 28.4 m -132.74 132.08 41.89 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.169 0.988 . . . . 0.0 111.184 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -119.97 159.55 24.5 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 128.03 2.532 . . . . 0.0 109.982 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 49.7 m -105.44 124.44 49.55 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.332 1.053 . . . . 0.0 109.468 178.216 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 54.1 t -118.45 150.37 39.69 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.849 1.259 . . . . 0.0 110.908 169.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 27.4 t -152.9 146.49 25.04 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 120.734 -1.229 . . . . 0.0 111.763 169.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 48.3 m-85 . . . . . 0 CA--C 1.536 0.413 0 C-N-CA 127.981 2.513 . . . . 0.0 110.887 172.801 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 51.6 p90 . . . . . 0 CA--C 1.538 0.49 0 CA-C-O 121.107 0.48 . . . . 0.0 112.171 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 24.8 t -96.05 133.58 36.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 125.48 1.512 . . . . 0.0 107.853 172.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 14.6 tp -99.42 140.76 33.13 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.445 1.098 . . . . 0.0 110.088 172.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -132.32 151.98 51.61 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.466 1.906 . . . . 0.0 110.507 -179.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 14.1 t90 -125.9 146.15 49.96 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.091 0.956 . . . . 0.0 112.405 178.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -141.07 143.52 34.4 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 -169.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -103.96 142.05 35.1 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.05 1.34 . . . . 0.0 107.951 167.126 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 22.6 mtp -88.49 145.91 25.48 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 118.897 0.771 . . . . 0.0 112.659 179.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 64.5 m -96.1 152.26 38.76 Favored Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 125.134 1.374 . . . . 0.0 110.923 171.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -67.52 -12.62 36.32 Favored 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 123.632 2.888 . . . . 0.0 113.621 -179.4 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 29.1 p -76.96 4.04 10.84 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 126.255 1.822 . . . . 0.0 113.633 169.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 59.8 t30 67.04 41.51 2.63 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.88 2.072 . . . . 0.0 111.347 -174.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 21.5 mm-40 -121.46 -172.69 2.47 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.59 1.956 . . . . 0.0 109.594 176.037 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 12.5 p -146.3 152.56 39.34 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.102 1.361 . . . . 0.0 111.404 -172.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -127.04 132.37 50.72 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.988 1.315 . . . . 0.0 110.919 173.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -78.75 124.98 28.76 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.484 1.114 . . . . 0.0 111.21 -175.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 74.0 mt -100.66 -44.61 5.77 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.341 1.456 . . . . 0.0 112.829 -169.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -166.21 170.92 12.79 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.165 1.786 . . . . 0.0 110.638 -171.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -155.93 163.43 39.76 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.661 1.184 . . . . 0.0 112.796 -177.017 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -141.8 121.31 8.1 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 125.269 1.428 . . . . 0.0 110.035 169.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo . . . . . 0 C--N 1.352 0.736 0 CA-C-N 120.378 1.171 . . . . 0.0 112.984 -7.287 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 43.7 mtm180 . . . . . 0 CA--C 1.532 0.286 0 N-CA-C 113.803 1.038 . . . . 0.0 113.803 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -65.03 129.46 39.79 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.356 1.462 . . . . 0.0 110.813 169.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 59.0 ttp85 -144.45 154.0 42.48 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.733 1.613 . . . . 0.0 112.102 -170.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 17.7 t -117.54 138.02 49.57 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 125.994 1.718 . . . . 0.0 110.166 173.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 3.1 m -114.54 128.38 56.3 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.237 1.415 . . . . 0.0 110.153 171.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 28.0 tp60 -84.84 122.38 29.07 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.531 1.132 . . . . 0.0 108.222 168.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 24.6 mt -84.56 154.96 62.52 Favored Pre-proline 0 N--CA 1.472 0.668 0 CA-C-O 118.766 -0.635 . . . . 0.0 110.751 176.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -65.95 -4.93 10.99 Favored 'Trans proline' 0 CA--C 1.54 0.777 0 C-N-CA 123.571 2.847 . . . . 0.0 113.926 176.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -64.95 -26.12 68.17 Favored 'General case' 0 CA--C 1.55 0.96 0 CA-C-N 119.434 1.016 . . . . 0.0 112.182 169.168 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 85.44 -34.09 3.34 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 126.592 2.044 . . . . 0.0 113.867 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 17.2 mtp180 -125.88 73.51 1.35 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.771 1.228 . . . . 0.0 109.197 174.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 174.12 142.2 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 128.757 2.823 . . . . 0.0 109.057 -174.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 84.6 m-85 -149.79 151.46 33.6 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.553 1.141 . . . . 0.0 112.66 -167.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 5.8 m-70 -116.34 114.48 24.37 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.512 0.725 . . . . 0.0 111.344 169.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 24.6 mmt -84.23 144.04 29.19 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.293 1.037 . . . . 0.0 109.371 172.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 72.3 p -151.36 151.77 32.21 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 115.565 1.691 . . . . 0.0 115.565 -179.146 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 16.0 t -109.69 116.2 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 125.526 1.531 . . . . 0.0 107.466 169.318 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 96.9 t -70.86 112.52 5.78 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 170.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 80.5 mtt85 57.49 77.09 0.29 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.392 1.477 . . . . 0.0 111.317 178.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.29 132.88 45.56 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.595 1.158 . . . . 0.0 111.325 -179.437 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 8.6 mpt_? -105.84 163.26 12.86 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.767 1.627 . . . . 0.0 109.989 176.143 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 73.9 mtm180 -57.52 -20.23 30.12 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 175.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -54.59 -29.95 53.06 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.977 1.711 . . . . 0.0 113.668 167.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 36.4 m-20 -93.21 -12.74 29.52 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.059 1.344 . . . . 0.0 114.551 -168.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 49.5 m -59.42 139.46 57.06 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 119.602 1.092 . . . . 0.0 112.768 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 149.35 -163.83 29.27 Favored Glycine 0 N--CA 1.472 1.053 0 C-N-CA 124.131 0.872 . . . . 0.0 113.435 -178.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.7 m -92.64 147.53 22.8 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.006 1.322 . . . . 0.0 110.702 -178.063 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -142.29 158.75 43.37 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.641 1.976 . . . . 0.0 111.253 -176.126 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.5 pp -154.36 158.84 40.69 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.914 1.286 . . . . 0.0 112.112 172.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 9.3 t -108.45 161.48 15.0 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.071 1.748 . . . . 0.0 110.291 177.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -157.46 155.3 26.29 Favored Glycine 0 N--CA 1.47 0.943 0 O-C-N 120.945 -1.097 . . . . 0.0 114.36 176.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -130.58 154.2 48.09 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.433 1.093 . . . . 0.0 112.818 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.6 tt -148.21 135.3 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 125.428 1.491 . . . . 0.0 110.528 176.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 23.3 m -67.04 161.1 25.16 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -179.285 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.26 -17.5 64.55 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 -175.657 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -78.51 148.9 74.33 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 124.744 1.218 . . . . 0.0 112.473 -177.36 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -67.9 -23.08 41.5 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.108 2.539 . . . . 0.0 113.069 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.8 pttp -80.31 -1.76 42.36 Favored 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 114.654 1.353 . . . . 0.0 114.654 176.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -67.83 164.32 19.89 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.731 1.212 . . . . 0.0 113.135 -179.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -137.05 155.77 49.24 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.771 1.628 . . . . 0.0 109.394 176.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 50.8 mt -79.24 125.25 38.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 123.343 0.657 . . . . 0.0 110.673 -176.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -95.69 120.91 36.79 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.899 1.68 . . . . 0.0 109.414 169.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -91.57 151.81 20.57 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.661 1.185 . . . . 0.0 112.223 -177.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 56.0 p -85.99 178.96 7.09 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.347 1.059 . . . . 0.0 112.426 169.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -71.67 159.33 34.59 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.523 -0.735 . . . . 0.0 110.688 166.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 70.3 mtt180 -75.41 143.43 42.73 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 123.991 0.916 . . . . 0.0 112.172 -178.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -124.17 166.46 15.79 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.749 2.02 . . . . 0.0 110.105 169.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -126.66 152.76 46.29 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.579 1.151 . . . . 0.0 111.707 177.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 64.7 tp -125.35 132.9 52.75 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 126.181 1.792 . . . . 0.0 109.4 172.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 53.9 ttp180 -123.0 117.19 24.91 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.948 1.299 . . . . 0.0 109.875 169.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 40.8 t -96.29 120.37 45.57 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 169.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 82.8 p -99.07 149.29 23.17 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.752 1.621 . . . . 0.0 109.932 177.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 38.8 mp0 -53.31 149.01 7.83 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.8 1.24 . . . . 0.0 113.402 -174.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 . . . . . 0 C--O 1.237 0.397 0 C-N-CA 124.543 1.137 . . . . 0.0 109.667 -178.838 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 17.0 p . . . . . 0 N--CA 1.473 0.704 0 CA-C-O 120.656 0.265 . . . . 0.0 111.185 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -120.85 140.09 52.25 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.97 1.308 . . . . 0.0 110.527 -174.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 16.9 m -140.91 156.76 68.47 Favored Pre-proline 0 CA--C 1.547 0.855 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 178.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -71.1 155.13 96.94 Favored 'Cis proline' 0 C--N 1.35 0.655 0 N-CA-C 110.367 -0.666 . . . . 0.0 110.367 -12.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.68 -30.19 67.18 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 173.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 46.0 tp -138.53 118.86 13.67 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.645 1.578 . . . . 0.0 109.095 170.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.4 tp -101.19 126.89 47.95 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.241 1.416 . . . . 0.0 109.229 172.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.6 t -109.79 124.54 66.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 171.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.8 m -128.09 174.28 11.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 C-N-CA 124.814 1.245 . . . . 0.0 111.284 172.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 33.8 m -104.34 151.85 22.96 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.657 1.583 . . . . 0.0 110.281 174.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -45.25 122.87 3.66 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.082 1.753 . . . . 0.0 112.509 171.728 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.27 0.42 89.48 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 125.902 1.715 . . . . 0.0 115.126 -179.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -88.08 155.77 19.63 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 119.768 1.784 . . . . 0.0 112.629 177.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -76.14 121.83 23.42 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.839 1.256 . . . . 0.0 110.771 173.13 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -101.4 131.45 47.48 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.112 0.965 . . . . 0.0 110.688 175.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 21.3 m -132.76 124.96 29.07 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.822 0.849 . . . . 0.0 111.531 -178.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -104.96 159.46 15.8 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 126.041 1.736 . . . . 0.0 111.102 170.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 32.2 m -120.52 138.59 53.76 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.615 1.566 . . . . 0.0 110.052 177.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 74.4 m -128.6 137.5 51.73 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.023 1.329 . . . . 0.0 110.938 169.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 47.6 p -124.89 140.9 52.51 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.39 0.676 . . . . 0.0 109.673 170.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 . . . . . 0 N--CA 1.466 0.374 0 N-CA-C 113.988 1.107 . . . . 0.0 113.988 -169.053 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 42.7 p90 . . . . . 0 CA--C 1.539 0.53 0 CA-C-O 121.137 0.494 . . . . 0.0 111.743 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 40.7 t -95.85 125.5 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 N-CA-C 106.487 -1.671 . . . . 0.0 106.487 169.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 37.6 tp -99.38 139.33 35.19 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 123.054 0.541 . . . . 0.0 109.647 174.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -128.16 137.12 51.94 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.544 1.538 . . . . 0.0 109.997 -176.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 68.9 t-105 -98.19 134.93 40.56 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.68 1.192 . . . . 0.0 110.699 173.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 90.5 m-85 -124.2 143.42 50.52 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.913 1.285 . . . . 0.0 112.805 -178.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 56.8 ttp85 -95.83 142.96 27.48 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 126.542 1.937 . . . . 0.0 107.874 167.157 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 33.1 mtp -91.61 144.89 25.07 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 118.826 0.739 . . . . 0.0 112.206 172.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 58.8 m -108.96 149.49 39.67 Favored Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 125.559 1.543 . . . . 0.0 110.85 171.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -69.01 -14.88 39.32 Favored 'Trans proline' 0 C--N 1.353 0.784 0 C-N-CA 123.879 3.053 . . . . 0.0 114.482 -171.023 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 6.1 t -76.91 7.92 4.31 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 119.098 0.863 . . . . 0.0 113.153 170.168 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 34.3 m-80 75.6 36.79 0.45 Allowed 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 127.896 2.479 . . . . 0.0 112.039 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -115.84 172.61 7.03 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.176 1.39 . . . . 0.0 111.007 179.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.8 p -132.62 152.49 51.63 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 125.842 1.657 . . . . 0.0 111.505 -178.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -138.51 125.89 21.77 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.539 1.536 . . . . 0.0 110.927 -177.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -77.64 125.33 29.17 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.138 0.975 . . . . 0.0 111.218 -176.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 25.4 mt -102.09 -43.35 5.78 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.894 0.878 . . . . 0.0 112.944 -179.016 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -157.46 168.13 28.22 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.377 1.471 . . . . 0.0 111.455 -172.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.66 167.86 27.41 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.44 1.096 . . . . 0.0 112.862 -178.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -142.22 126.16 9.84 Favored Pre-proline 0 CA--C 1.543 0.674 0 C-N-CA 124.661 1.185 . . . . 0.0 110.33 169.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo . . . . . 0 C--N 1.351 0.677 0 CA-C-N 119.355 0.805 . . . . 0.0 112.725 -10.649 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 5.2 ptm180 . . . . . 0 N--CA 1.47 0.535 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -97.8 125.53 42.69 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.898 1.279 . . . . 0.0 109.33 172.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -142.94 152.53 42.11 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.472 1.109 . . . . 0.0 111.945 -169.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 49.0 t -126.6 139.85 50.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.116 0 C-N-CA 124.856 1.262 . . . . 0.0 111.021 176.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 97.4 m -123.38 128.89 50.51 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.538 1.535 . . . . 0.0 109.509 170.046 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 37.2 tt0 -85.9 137.74 32.53 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.887 0.875 . . . . 0.0 110.149 170.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 34.3 mt -91.1 157.31 43.14 Favored Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 124.357 1.063 . . . . 0.0 111.894 -179.051 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -66.75 -3.85 10.08 Favored 'Trans proline' 0 CA--C 1.542 0.91 0 C-N-CA 123.664 2.91 . . . . 0.0 114.028 174.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -66.59 -13.66 61.37 Favored 'General case' 0 CA--C 1.555 1.147 0 CA-C-N 119.378 0.99 . . . . 0.0 112.951 170.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 92.32 -24.57 21.85 Favored Glycine 0 N--CA 1.476 1.307 0 C-N-CA 125.916 1.722 . . . . 0.0 115.716 168.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 11.5 ptp180 -154.5 73.64 0.92 Allowed 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.534 1.534 . . . . 0.0 109.695 172.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -168.89 137.0 2.01 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 128.074 2.55 . . . . 0.0 107.273 -171.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 55.1 m-85 -148.78 146.58 28.09 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -167.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 4.8 m-70 -106.03 132.5 52.04 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.283 1.433 . . . . 0.0 111.116 168.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 2.6 mpp? -112.1 120.31 41.4 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 126.361 1.864 . . . . 0.0 109.365 177.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 36.0 m -116.22 130.89 57.01 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.322 1.049 . . . . 0.0 112.211 -169.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 58.1 t -105.66 110.79 32.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 125.775 1.63 . . . . 0.0 107.13 168.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 96.8 t -76.29 123.44 32.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.495 1.118 . . . . 0.0 109.55 178.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 53.63 73.43 0.38 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.053 1.741 . . . . 0.0 111.574 177.047 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.87 132.26 44.15 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.195 0.998 . . . . 0.0 111.269 -179.136 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -106.94 161.65 14.53 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 126.198 1.799 . . . . 0.0 110.104 177.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -50.68 -35.79 32.69 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 119.292 0.951 . . . . 0.0 113.377 -178.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -62.88 -21.1 65.74 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 125.564 1.546 . . . . 0.0 115.003 176.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -76.4 -11.87 59.96 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 119.69 1.132 . . . . 0.0 113.116 177.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.9 m -62.93 131.08 47.5 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 120.617 -1.302 . . . . 0.0 112.349 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 156.99 -168.77 34.04 Favored Glycine 0 N--CA 1.472 1.055 0 C-N-CA 124.381 0.991 . . . . 0.0 113.703 -173.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.2 m -95.8 142.48 28.03 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.623 1.169 . . . . 0.0 111.219 -175.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -146.1 160.91 41.27 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.149 1.78 . . . . 0.0 111.071 -177.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -161.77 169.07 22.08 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 120.871 -1.143 . . . . 0.0 113.99 -175.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 6.4 m -107.06 148.26 28.96 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.178 1.391 . . . . 0.0 112.356 175.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -145.66 135.77 6.1 Favored Glycine 0 N--CA 1.469 0.859 0 C-N-CA 125.02 1.295 . . . . 0.0 111.523 169.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -113.96 157.28 22.65 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.008 0.923 . . . . 0.0 112.82 -176.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 19.7 tt -143.41 131.49 18.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 125.141 1.377 . . . . 0.0 110.226 172.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 15.3 m -68.27 161.61 26.88 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.179 1.392 . . . . 0.0 114.152 -171.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.9 -10.92 32.36 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 116.119 1.896 . . . . 0.0 116.119 -176.576 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -81.47 149.83 65.76 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.766 1.227 . . . . 0.0 112.427 -178.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -68.09 -21.5 42.63 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 123.038 2.492 . . . . 0.0 112.699 175.59 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 1.9 tppp? -81.52 -4.07 54.93 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 125.217 1.407 . . . . 0.0 113.66 177.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.5 164.69 13.5 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.813 1.245 . . . . 0.0 113.986 -175.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 38.0 tt0 -152.44 141.25 21.02 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.228 1.811 . . . . 0.0 108.437 -178.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 60.7 mt -59.62 140.5 17.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 124.189 0.996 . . . . 0.0 112.227 -172.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 32.5 mmtm -125.74 124.33 40.8 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.743 1.617 . . . . 0.0 110.306 169.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -147.74 141.92 26.12 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.119 1.767 . . . . 0.0 110.93 -174.417 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 8.4 t -173.35 156.65 3.14 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 126.259 1.824 . . . . 0.0 109.982 -179.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.1 mp 68.94 173.88 0.29 Allowed 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 127.293 2.237 . . . . 0.0 111.209 -169.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -159.63 168.22 26.57 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.611 1.564 . . . . 0.0 112.49 173.6 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -128.93 161.62 29.46 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 126.946 2.098 . . . . 0.0 110.892 173.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -116.53 139.28 50.66 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.802 1.241 . . . . 0.0 111.081 -178.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 54.4 tp -108.82 132.8 53.65 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 125.684 1.593 . . . . 0.0 109.929 171.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 66.2 ttt180 -122.49 119.38 30.75 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.901 1.68 . . . . 0.0 109.153 169.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 38.6 t -104.64 115.27 46.22 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 124.211 1.004 . . . . 0.0 108.557 171.141 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 80.8 p -87.58 153.3 21.5 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.004 1.721 . . . . 0.0 110.144 177.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 4.2 pm0 -66.52 154.58 39.98 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.696 0.798 . . . . 0.0 112.884 -178.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 19.8 tpt180 . . . . . 0 N--CA 1.466 0.37 0 C-N-CA 123.99 0.916 . . . . 0.0 109.646 -173.152 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.5 t . . . . . 0 N--CA 1.467 0.417 0 CA-C-O 121.723 0.773 . . . . 0.0 112.191 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 82.8 t80 -145.45 118.06 8.6 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 127.419 2.288 . . . . 0.0 108.732 -175.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 97.8 p -140.84 161.56 53.38 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 124.808 1.243 . . . . 0.0 113.645 -168.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -67.67 161.53 78.85 Favored 'Cis proline' 0 C--N 1.355 0.886 0 CA-C-N 120.041 1.051 . . . . 0.0 111.707 -4.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.64 -24.75 67.76 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 176.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 13.5 tp -139.71 121.04 14.94 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 126.015 1.726 . . . . 0.0 108.487 171.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 61.3 tp -109.67 121.35 45.01 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.38 1.072 . . . . 0.0 108.591 168.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 14.3 p -109.95 126.46 67.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 123.867 0.867 . . . . 0.0 109.779 171.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 27.0 m -130.77 165.77 30.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 125.006 1.323 . . . . 0.0 111.964 176.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.3 m -89.44 147.8 23.81 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.748 1.219 . . . . 0.0 110.489 172.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -52.85 125.99 18.76 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.483 1.113 . . . . 0.0 111.393 174.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 91.06 -2.44 79.25 Favored Glycine 0 CA--C 1.534 1.231 0 C-N-CA 125.305 1.431 . . . . 0.0 114.75 -176.319 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -87.04 157.19 19.48 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 119.704 1.752 . . . . 0.0 112.275 175.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 53.6 m-20 -90.24 104.45 17.02 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.2 1.0 . . . . 0.0 110.234 178.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -90.27 111.87 23.21 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.843 0.857 . . . . 0.0 111.583 -171.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 25.8 m -113.61 125.13 53.83 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 118.716 0.689 . . . . 0.0 112.318 -173.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -101.89 159.59 15.21 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 127.094 2.158 . . . . 0.0 110.229 169.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.0 m -112.39 132.89 54.78 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.011 1.324 . . . . 0.0 109.847 174.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 43.1 t -117.51 144.4 45.11 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.765 1.626 . . . . 0.0 111.336 171.451 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 46.8 t -147.08 141.51 26.41 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.361 -0.837 . . . . 0.0 111.756 173.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 . . . . . 0 N--CA 1.467 0.395 0 C-N-CA 126.529 1.932 . . . . 0.0 113.948 -176.472 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 53.2 p90 . . . . . 0 CA--C 1.537 0.464 0 CA-C-O 121.028 0.442 . . . . 0.0 111.48 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 49.1 t -96.07 128.7 47.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 C-N-CA 125.224 1.409 . . . . 0.0 107.68 173.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -112.95 122.02 46.38 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.433 1.493 . . . . 0.0 109.006 -175.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 11.4 m-80 -122.57 158.53 29.71 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.369 1.467 . . . . 0.0 112.788 -168.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 10.0 t90 -124.18 137.69 54.51 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 125.311 1.444 . . . . 0.0 112.068 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -132.99 141.09 48.11 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.786 1.234 . . . . 0.0 113.077 -176.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.5 ttt-85 -101.14 140.93 34.74 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.393 1.477 . . . . 0.0 108.258 168.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 29.8 mtp -91.98 145.92 24.15 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 119.04 0.836 . . . . 0.0 111.978 178.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 67.4 m -96.64 158.95 32.8 Favored Pre-proline 0 CA--C 1.549 0.906 0 C-N-CA 124.369 1.068 . . . . 0.0 112.064 174.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -56.57 -34.26 94.9 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 123.944 3.096 . . . . 0.0 113.654 174.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 9.6 m -77.01 18.03 0.4 Allowed 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.617 1.567 . . . . 0.0 113.529 175.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . 0.318 13.6 p30 58.01 21.04 7.37 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 128.263 2.625 . . . . 0.0 115.623 -176.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 18.7 mm100 -82.98 -178.06 6.99 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.052 0.941 . . . . 0.0 110.556 169.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -148.65 141.99 25.18 Favored 'General case' 0 CA--C 1.518 -0.271 0 C-N-CA 127.185 2.194 . . . . 0.0 108.546 -171.399 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -127.27 120.06 27.77 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 125.846 1.659 . . . . 0.0 109.359 -172.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 57.8 tttm -76.92 117.02 18.1 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.888 1.275 . . . . 0.0 110.868 -176.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 37.2 mt -94.45 -50.04 5.4 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.834 1.254 . . . . 0.0 112.966 -168.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -171.23 170.46 6.03 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.74 2.016 . . . . 0.0 110.33 -169.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.69 165.53 32.41 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.588 1.155 . . . . 0.0 112.963 -176.46 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -129.93 130.21 23.12 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 125.95 1.7 . . . . 0.0 109.268 169.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo . . . . . 0 C--N 1.351 0.67 0 CA-C-N 120.359 1.164 . . . . 0.0 112.734 -7.026 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 89.6 mtt180 . . . . . 0 N--CA 1.471 0.597 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -85.69 122.03 29.21 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.477 1.111 . . . . 0.0 111.966 -169.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -140.32 140.55 35.65 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.967 1.307 . . . . 0.0 110.539 -173.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.5 t -126.52 130.87 71.77 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 124.922 1.289 . . . . 0.0 110.01 -177.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 89.7 m -130.17 127.99 40.84 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.933 1.293 . . . . 0.0 110.427 -179.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -79.97 140.11 36.76 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.114 0.965 . . . . 0.0 110.997 173.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 27.1 mt -97.63 159.32 31.33 Favored Pre-proline 0 CA--C 1.546 0.827 0 C-N-CA 125.056 1.342 . . . . 0.0 111.487 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -67.0 -3.68 10.11 Favored 'Trans proline' 0 CA--C 1.543 0.944 0 C-N-CA 123.681 2.921 . . . . 0.0 114.351 175.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -69.05 -8.86 49.06 Favored 'General case' 0 CA--C 1.557 1.243 0 CA-C-N 119.364 0.983 . . . . 0.0 113.277 172.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 90.01 -34.08 4.23 Favored Glycine 0 N--CA 1.476 1.351 0 C-N-CA 126.439 1.971 . . . . 0.0 115.971 168.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 78.9 mtt85 -140.06 73.61 1.43 Allowed 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.862 1.265 . . . . 0.0 109.11 169.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -165.79 136.06 3.54 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 125.649 1.58 . . . . 0.0 108.577 -171.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -146.89 131.46 17.77 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.96 0.904 . . . . 0.0 111.734 -167.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 5.0 m-70 -94.53 133.87 37.69 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.743 0.817 . . . . 0.0 110.7 169.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 32.1 mtt -123.44 105.31 9.69 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 126.387 1.875 . . . . 0.0 109.242 -174.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 7.2 t -112.83 128.91 56.57 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -169.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 15.2 t -92.86 90.09 2.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 106.588 -1.634 . . . . 0.0 106.588 168.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 72.5 t -64.84 131.34 30.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 123.451 0.7 . . . . 0.0 109.236 177.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 3.5 tpp180 62.81 45.78 5.5 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.786 1.235 . . . . 0.0 112.136 173.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.33 138.12 58.42 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.583 -0.698 . . . . 0.0 112.724 -169.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 51.8 mmm-85 -116.42 163.76 15.57 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 126.178 1.791 . . . . 0.0 110.39 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 33.2 mtm105 -55.39 -25.42 35.5 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 179.339 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -71.72 -18.82 62.12 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 174.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -79.72 -27.37 40.62 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 119.736 1.153 . . . . 0.0 112.329 177.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 50.8 m -49.47 139.79 11.53 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.822 1.249 . . . . 0.0 113.152 179.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 147.22 -167.15 28.47 Favored Glycine 0 N--CA 1.472 1.055 0 C-N-CA 124.535 1.064 . . . . 0.0 113.089 -174.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.7 m -91.93 148.17 22.41 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.996 1.318 . . . . 0.0 110.833 -177.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 65.7 m-85 -147.41 157.95 43.78 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.907 1.683 . . . . 0.0 112.083 -174.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -158.4 159.27 35.58 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.993 1.317 . . . . 0.0 113.492 175.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 49.7 t -104.03 148.6 26.03 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.257 1.823 . . . . 0.0 111.255 178.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -151.77 136.44 5.48 Favored Glycine 0 N--CA 1.474 1.179 0 C-N-CA 123.743 0.687 . . . . 0.0 114.308 177.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -113.84 155.68 25.27 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.74 1.216 . . . . 0.0 113.046 -176.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 18.5 tt -146.51 132.79 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 125.316 1.446 . . . . 0.0 110.436 172.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 16.4 m -72.46 161.13 31.23 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.529 1.131 . . . . 0.0 112.954 -178.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.58 -10.13 49.09 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 115.946 1.832 . . . . 0.0 115.946 -178.515 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -71.52 147.55 92.53 Favored Pre-proline 0 CA--C 1.549 0.926 0 C-N-CA 124.241 1.016 . . . . 0.0 112.303 -178.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -67.57 -21.89 45.34 Favored 'Trans proline' 0 CA--C 1.538 0.725 0 C-N-CA 122.982 2.455 . . . . 0.0 112.807 177.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -85.99 -0.82 56.45 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 124.874 1.269 . . . . 0.0 113.893 176.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.9 157.17 31.33 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.245 1.018 . . . . 0.0 113.094 -177.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 84.6 mt-30 -138.0 158.62 43.96 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.118 1.767 . . . . 0.0 108.916 175.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 57.9 mt -78.23 118.27 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 121.745 -0.597 . . . . 0.0 110.578 -175.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 3.8 ttmp? -94.19 131.43 39.76 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.272 1.429 . . . . 0.0 109.12 169.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -114.51 149.74 35.94 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.18 0.992 . . . . 0.0 112.504 -170.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 51.7 m -88.37 164.97 15.27 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.295 1.438 . . . . 0.0 113.132 174.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -66.7 139.52 57.84 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.566 0.746 . . . . 0.0 109.408 168.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.55 166.62 23.29 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 -173.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -142.28 169.6 17.27 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 127.227 2.211 . . . . 0.0 110.668 172.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -116.74 144.69 44.15 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 174.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 66.9 tp -102.67 135.91 43.44 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 127.141 2.176 . . . . 0.0 109.224 169.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 35.3 ttm180 -131.6 108.54 9.6 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.339 1.456 . . . . 0.0 109.503 -179.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 35.9 t -99.82 115.22 40.35 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 124.198 0.999 . . . . 0.0 109.064 176.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 82.8 p -97.03 154.88 17.05 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.891 1.676 . . . . 0.0 110.664 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -63.09 142.49 58.36 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.304 0.642 . . . . 0.0 112.455 -176.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 48.7 ttt85 . . . . . 0 N--CA 1.467 0.407 0 C-N-CA 123.87 0.868 . . . . 0.0 110.826 -179.087 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.1 t . . . . . 0 C--O 1.237 0.434 0 CA-C-O 121.276 0.56 . . . . 0.0 111.055 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -120.7 114.27 21.42 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 126.079 1.752 . . . . 0.0 106.819 171.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 67.6 m -130.94 151.99 79.89 Favored Pre-proline 0 N--CA 1.475 0.811 0 N-CA-C 114.144 1.165 . . . . 0.0 114.144 -169.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -68.55 152.52 89.0 Favored 'Cis proline' 0 C--N 1.353 0.779 0 CA-C-N 118.79 0.604 . . . . 0.0 111.257 -4.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -55.94 -28.63 57.76 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 176.394 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 45.1 tp -137.16 114.46 10.88 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.46 1.504 . . . . 0.0 108.302 168.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 44.7 tp -96.74 126.62 42.03 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.96 1.304 . . . . 0.0 109.187 173.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.7 t -111.77 122.84 66.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 124.142 0.977 . . . . 0.0 108.472 172.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 33.6 m -126.54 167.98 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 124.347 1.059 . . . . 0.0 111.997 174.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 22.7 m -91.12 146.64 23.67 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.779 1.232 . . . . 0.0 110.128 172.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -52.41 120.15 5.25 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.469 1.108 . . . . 0.0 111.78 174.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 97.86 -1.58 59.71 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 126.083 1.801 . . . . 0.0 114.804 -177.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -89.62 155.06 19.49 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 119.556 1.678 . . . . 0.0 112.556 178.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 66.8 m-20 -83.21 106.08 14.71 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.012 0.925 . . . . 0.0 110.182 177.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -89.66 111.9 22.99 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.841 0.856 . . . . 0.0 110.872 -176.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 33.8 m -120.08 125.53 48.51 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.961 0.904 . . . . 0.0 111.496 -175.289 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -96.98 146.92 24.51 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 126.05 1.74 . . . . 0.0 110.684 170.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 88.4 m -94.17 123.92 37.86 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.003 1.321 . . . . 0.0 108.081 169.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 37.2 t -122.74 122.6 39.13 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.878 1.671 . . . . 0.0 109.774 -176.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 42.4 t -143.74 127.5 17.2 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 121.45 -0.781 . . . . 0.0 111.067 -169.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 33.6 p90 . . . . . 0 CA--C 1.537 0.448 0 C-N-CA 125.472 1.509 . . . . 0.0 111.653 169.861 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 32.5 p90 . . . . . 0 CA--C 1.537 0.473 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 91.4 t -96.19 134.22 34.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 C-N-CA 126.216 1.806 . . . . 0.0 108.616 169.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -100.39 128.31 46.49 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.246 1.019 . . . . 0.0 108.427 168.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 28.3 m120 -120.48 157.14 30.03 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.513 1.925 . . . . 0.0 111.423 -176.076 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 17.1 t90 -135.03 143.76 46.92 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.32 1.048 . . . . 0.0 112.821 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -141.4 148.51 39.69 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.907 1.283 . . . . 0.0 114.097 -169.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 59.1 ttt85 -104.45 143.21 33.32 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.453 1.501 . . . . 0.0 108.172 167.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 33.8 mtp -86.49 145.07 26.96 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.354 0.979 . . . . 0.0 112.388 174.356 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 74.1 m -107.4 152.19 41.19 Favored Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 125.612 1.565 . . . . 0.0 111.478 177.096 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -68.57 -17.35 43.23 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 124.102 3.201 . . . . 0.0 113.608 -175.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.3 m -76.92 9.09 3.14 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.849 1.26 . . . . 0.0 113.005 171.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 58.9 t30 69.63 46.51 0.71 Allowed 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 127.402 2.281 . . . . 0.0 111.901 178.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -137.72 -172.61 3.28 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.077 1.351 . . . . 0.0 110.922 176.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.2 p -138.05 151.05 47.48 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 125.847 1.659 . . . . 0.0 110.474 -172.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -127.76 131.8 49.62 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 124.878 1.271 . . . . 0.0 111.224 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -78.44 118.84 20.98 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.316 1.447 . . . . 0.0 111.404 -172.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 86.1 mt -97.41 -51.12 4.27 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.773 1.229 . . . . 0.0 112.278 -170.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -168.51 171.32 9.04 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.748 1.619 . . . . 0.0 109.858 -174.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.51 163.06 35.54 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.803 1.241 . . . . 0.0 111.351 -176.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 38.9 t80 -138.07 116.22 9.54 Favored Pre-proline 0 CA--C 1.546 0.818 0 C-N-CA 124.032 0.933 . . . . 0.0 110.543 169.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo . . . . . 0 CA--C 1.539 0.765 0 CA-C-N 119.286 0.781 . . . . 0.0 111.379 -8.553 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 66.2 mtt85 . . . . . 0 N--CA 1.469 0.505 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -83.08 132.37 35.12 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 -165.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -143.82 141.31 30.31 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.384 1.474 . . . . 0.0 111.746 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 89.8 t -123.72 129.1 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 C-N-CA 125.552 1.541 . . . . 0.0 109.065 170.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 89.0 m -129.86 131.44 46.1 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.155 1.382 . . . . 0.0 110.074 -179.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -82.93 135.92 34.74 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.947 0.899 . . . . 0.0 110.359 173.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 33.2 mt -88.31 163.02 38.25 Favored Pre-proline 0 CA--C 1.547 0.842 0 C-N-CA 123.569 0.748 . . . . 0.0 111.987 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.74 -22.93 38.83 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 123.996 3.131 . . . . 0.0 114.009 170.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 58.5 t30 -65.14 -12.19 48.3 Favored 'General case' 0 CA--C 1.555 1.173 0 C-N-CA 124.26 1.024 . . . . 0.0 113.445 175.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 78.25 -34.11 1.76 Allowed Glycine 0 N--CA 1.476 1.351 0 C-N-CA 127.677 2.56 . . . . 0.0 116.352 168.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 2.5 ppt_? -130.13 73.47 1.53 Allowed 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 123.512 1.625 . . . . 0.0 108.32 171.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 11.1 t0 179.76 136.91 0.11 Allowed 'General case' 0 C--O 1.238 0.485 0 C-N-CA 128.515 2.726 . . . . 0.0 108.415 -169.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -145.85 148.51 32.95 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 124.222 1.009 . . . . 0.0 112.35 -168.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 14.2 m170 -105.68 123.59 48.17 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.079 1.352 . . . . 0.0 111.099 169.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -110.96 111.3 22.33 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 126.813 2.045 . . . . 0.0 108.01 -178.106 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 8.4 t -123.7 134.3 53.73 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 115.317 1.599 . . . . 0.0 115.317 -168.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 25.7 t -99.33 93.57 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 126.42 1.888 . . . . 0.0 106.153 167.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 98.0 t -66.9 127.23 28.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 124.882 1.273 . . . . 0.0 109.536 178.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 68.8 ttt180 57.65 55.68 5.4 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.767 1.627 . . . . 0.0 111.653 178.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -72.56 140.53 48.15 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.001 0.92 . . . . 0.0 112.616 -172.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 60.6 mtp85 -129.32 168.53 16.11 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.766 1.626 . . . . 0.0 110.26 -174.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 51.5 mtm180 -61.84 -17.58 56.88 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 115.598 1.703 . . . . 0.0 115.598 -169.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -71.37 -22.84 61.84 Favored 'General case' 0 CA--C 1.553 1.064 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 169.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 -86.55 -13.54 45.56 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 125.377 1.471 . . . . 0.0 113.574 -176.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 41.4 m -55.61 137.82 48.29 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 120.986 -1.071 . . . . 0.0 111.183 169.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 151.61 -165.98 30.65 Favored Glycine 0 N--CA 1.471 0.97 0 O-C-N 121.445 -0.785 . . . . 0.0 113.504 -176.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.9 m -98.5 140.83 32.16 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.879 1.272 . . . . 0.0 110.895 -172.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -140.26 154.12 46.75 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.084 1.354 . . . . 0.0 112.568 -175.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.3 pp -158.35 153.99 26.32 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.944 1.298 . . . . 0.0 112.778 179.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 14.4 m -95.47 159.91 14.77 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.604 0.761 . . . . 0.0 112.121 172.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -143.8 175.26 23.82 Favored Glycine 0 CA--C 1.527 0.823 0 C-N-CA 125.35 1.452 . . . . 0.0 111.56 168.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -158.54 159.24 35.33 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 118.635 1.217 . . . . 0.0 113.96 -178.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 16.9 tt -150.22 138.94 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 125.417 1.487 . . . . 0.0 110.564 177.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 13.5 m -69.51 159.67 32.88 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.321 1.048 . . . . 0.0 112.668 176.39 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 40.9 mt -75.17 -11.87 60.17 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 177.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -65.59 148.78 97.93 Favored Pre-proline 0 CA--C 1.552 1.029 0 C-N-CA 124.405 1.082 . . . . 0.0 112.367 175.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -69.47 -20.19 36.55 Favored 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 123.141 2.561 . . . . 0.0 113.194 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -87.23 3.64 45.75 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.715 1.206 . . . . 0.0 113.886 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -67.31 164.56 18.18 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.871 1.268 . . . . 0.0 113.957 -175.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 22.1 pt20 -149.1 163.5 37.4 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.417 1.887 . . . . 0.0 109.756 176.28 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 54.8 mt -83.83 135.78 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 CA-C-O 121.554 0.693 . . . . 0.0 112.744 -171.356 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -95.99 144.67 26.08 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 127.502 2.321 . . . . 0.0 109.74 167.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.9 mp0 -143.03 158.82 43.24 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 126.543 1.937 . . . . 0.0 109.801 170.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 4.1 t -150.08 -170.35 3.62 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 175.07 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -61.5 130.68 47.17 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.13 1.772 . . . . 0.0 114.109 -169.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.73 167.18 22.31 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 115.872 1.804 . . . . 0.0 115.872 -169.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -123.27 169.67 11.06 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 127.33 2.252 . . . . 0.0 110.812 169.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -126.64 143.97 51.06 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.994 1.318 . . . . 0.0 111.846 -177.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 49.8 tp -114.08 136.7 52.64 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 126.354 1.861 . . . . 0.0 110.293 173.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 59.6 ttt85 -127.49 123.37 35.78 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 126.171 1.788 . . . . 0.0 109.944 170.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 44.9 t -102.96 123.57 56.45 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 124.612 1.165 . . . . 0.0 108.679 169.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 79.6 p -99.77 158.64 15.64 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.744 1.618 . . . . 0.0 110.882 176.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -58.52 150.85 21.69 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.421 1.088 . . . . 0.0 112.894 -178.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 11.9 ttm180 . . . . . 0 C--O 1.237 0.416 0 C-N-CA 123.695 0.798 . . . . 0.0 109.982 -174.619 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 33.7 m . . . . . 0 N--CA 1.471 0.621 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -143.28 117.91 9.81 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.671 1.589 . . . . 0.0 109.043 179.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 88.6 p -140.94 159.89 60.36 Favored Pre-proline 0 CA--C 1.551 0.994 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 -168.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.3 162.51 79.31 Favored 'Cis proline' 0 C--N 1.356 0.925 0 CA-C-N 120.058 1.057 . . . . 0.0 111.912 -3.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.74 -24.05 67.61 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 177.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 47.9 tp -142.0 124.15 15.49 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 125.341 1.457 . . . . 0.0 108.658 169.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 53.7 tp -111.25 126.57 55.02 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.064 1.346 . . . . 0.0 109.255 171.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.2 t -111.51 122.57 66.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.966 0.907 . . . . 0.0 109.252 175.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.1 m -126.63 173.24 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 125.132 1.373 . . . . 0.0 111.342 170.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 99.1 m -104.84 151.79 23.4 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.49 1.516 . . . . 0.0 110.228 172.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -51.77 125.56 15.38 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.281 1.032 . . . . 0.0 112.562 174.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.84 -3.46 74.07 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 126.054 1.788 . . . . 0.0 114.531 -176.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -92.61 154.37 18.43 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 119.594 1.697 . . . . 0.0 111.523 175.033 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -85.17 127.39 34.25 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 121.505 0.669 . . . . 0.0 111.305 171.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -103.83 128.13 51.29 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.737 1.615 . . . . 0.0 110.083 178.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 27.7 m -128.66 127.87 43.02 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.064 0.945 . . . . 0.0 111.371 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -103.28 158.83 16.05 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.553 1.941 . . . . 0.0 110.59 170.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 85.5 m -101.2 134.21 44.59 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.058 1.343 . . . . 0.0 109.261 169.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 44.8 t -115.16 134.06 55.49 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.432 1.893 . . . . 0.0 110.011 170.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 66.8 m -138.69 130.34 27.63 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.194 0.997 . . . . 0.0 111.042 -173.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 40.9 p90 . . . . . 0 CA--C 1.537 0.469 0 C-N-CA 125.494 1.518 . . . . 0.0 110.535 179.428 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 40.8 p90 . . . . . 0 CA--C 1.538 0.5 0 CA-C-O 120.993 0.425 . . . . 0.0 111.924 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 87.7 t -111.03 128.43 67.48 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 C-N-CA 125.612 1.565 . . . . 0.0 108.075 169.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 58.8 tp -106.37 134.05 50.11 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 125.243 1.417 . . . . 0.0 108.883 169.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -127.16 150.47 49.49 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.152 1.381 . . . . 0.0 110.825 178.033 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 11.7 t90 -117.62 139.99 50.24 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.473 1.109 . . . . 0.0 111.236 176.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -133.29 146.86 51.77 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.703 1.201 . . . . 0.0 113.626 -172.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -111.07 138.67 47.19 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.608 1.563 . . . . 0.0 108.276 168.042 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 28.3 mtp -85.05 143.62 28.77 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 118.846 0.748 . . . . 0.0 112.339 -178.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.4 m -100.43 154.05 37.41 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 125.212 1.405 . . . . 0.0 111.918 178.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.83 -30.98 79.17 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 124.442 3.428 . . . . 0.0 114.704 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.0 m -77.0 10.74 2.13 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.079 1.352 . . . . 0.0 113.593 178.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 66.38 43.6 2.63 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.775 2.03 . . . . 0.0 111.353 -176.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 -121.55 -172.73 2.48 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.551 1.541 . . . . 0.0 109.88 175.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.1 p -144.74 144.23 31.09 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.638 1.575 . . . . 0.0 110.609 -173.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -121.54 132.43 54.7 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.721 1.208 . . . . 0.0 111.347 176.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -77.66 128.27 33.82 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.866 1.266 . . . . 0.0 111.335 -177.334 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 60.0 mt -104.7 -44.5 4.85 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.196 1.398 . . . . 0.0 113.544 -168.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -171.27 174.93 4.38 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 128.085 2.554 . . . . 0.0 109.395 -174.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.6 166.57 30.45 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.314 1.046 . . . . 0.0 112.769 -170.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -142.89 115.25 6.03 Favored Pre-proline 0 CA--C 1.546 0.821 0 C-N-CA 125.435 1.494 . . . . 0.0 109.67 169.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo . . . . . 0 C--N 1.351 0.705 0 CA-C-N 119.941 1.015 . . . . 0.0 112.665 -10.75 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 13.0 ptp180 . . . . . 0 N--CA 1.473 0.695 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -93.99 140.02 30.22 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.32 1.448 . . . . 0.0 111.339 -176.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -137.86 145.27 41.99 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.298 1.439 . . . . 0.0 111.123 178.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 58.1 t -126.54 125.23 66.87 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 125.538 1.535 . . . . 0.0 108.734 174.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 84.8 m -130.49 129.28 42.72 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.818 1.247 . . . . 0.0 110.655 -174.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.7 pm0 -76.61 141.32 41.1 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.792 1.237 . . . . 0.0 111.605 175.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 38.0 mt -93.92 157.82 37.34 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 123.829 0.852 . . . . 0.0 111.628 177.061 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -65.71 -3.56 8.24 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 123.551 2.834 . . . . 0.0 114.028 174.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -62.41 -26.14 68.33 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 119.441 1.018 . . . . 0.0 112.739 169.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 92.34 -15.7 61.6 Favored Glycine 0 N--CA 1.474 1.226 0 C-N-CA 125.659 1.599 . . . . 0.0 114.547 175.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.41 73.51 0.91 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.769 1.628 . . . . 0.0 109.995 170.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -174.64 147.43 1.06 Allowed 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 127.223 2.209 . . . . 0.0 109.054 -177.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 60.6 m-85 -143.62 151.29 39.96 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 114.103 1.149 . . . . 0.0 114.103 -168.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 13.5 m170 -110.01 139.32 45.25 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.684 1.594 . . . . 0.0 109.625 167.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 46.1 mtt -128.84 123.73 33.53 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.896 1.278 . . . . 0.0 109.212 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 88.9 p -130.48 139.12 50.54 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 115.739 1.755 . . . . 0.0 115.739 -168.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 15.5 t -98.11 104.02 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 125.922 1.689 . . . . 0.0 106.656 169.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 60.7 t -81.48 128.67 38.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 123.647 0.779 . . . . 0.0 109.868 -176.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 50.1 ttt85 56.23 53.62 8.7 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.224 1.41 . . . . 0.0 111.017 178.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.43 145.83 55.64 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.614 1.166 . . . . 0.0 112.106 -170.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 33.8 mmm-85 -118.92 168.05 11.15 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.884 1.674 . . . . 0.0 110.489 178.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 44.3 mtm180 -57.78 -20.54 36.08 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 120.862 -1.149 . . . . 0.0 113.738 173.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -59.57 -22.86 62.34 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.248 1.419 . . . . 0.0 113.893 168.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -94.92 -13.28 25.54 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.214 1.406 . . . . 0.0 114.435 -175.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 67.2 m -60.71 134.89 57.53 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-N 120.349 1.431 . . . . 0.0 112.616 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 155.92 -165.78 32.76 Favored Glycine 0 N--CA 1.473 1.139 0 O-C-N 121.247 -0.908 . . . . 0.0 113.571 -177.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.0 m -95.98 139.61 31.93 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.501 1.12 . . . . 0.0 110.747 -177.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 61.3 m-85 -137.41 156.39 48.25 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.074 1.75 . . . . 0.0 112.558 -176.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -161.96 147.85 13.39 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.797 1.639 . . . . 0.0 112.134 176.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 24.7 p -94.46 159.16 15.23 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.698 0.799 . . . . 0.0 112.655 169.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -148.07 131.48 3.84 Favored Glycine 0 CA--C 1.529 0.91 0 C-N-CA 124.766 1.174 . . . . 0.0 112.639 173.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -115.11 147.41 40.26 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.563 1.145 . . . . 0.0 112.634 -176.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 18.6 tt -148.14 136.38 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 125.189 1.396 . . . . 0.0 111.007 178.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 31.5 m -72.15 155.38 40.32 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 121.101 -0.999 . . . . 0.0 111.853 174.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.68 -10.78 58.34 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 115.775 1.769 . . . . 0.0 115.775 -174.708 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -75.27 140.63 73.0 Favored Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 124.137 0.975 . . . . 0.0 111.935 179.262 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -55.28 -23.43 37.39 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 123.875 3.05 . . . . 0.0 114.797 174.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -71.2 -13.91 62.08 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 124.968 1.307 . . . . 0.0 114.099 177.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -74.73 161.47 29.6 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.24 1.416 . . . . 0.0 113.839 -176.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 28.5 mp0 -132.41 156.99 45.68 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.379 1.872 . . . . 0.0 108.573 170.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 33.7 mt -75.91 116.38 18.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 O-C-N 121.731 -0.606 . . . . 0.0 109.98 178.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.3 88.47 4.94 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.026 0.93 . . . . 0.0 109.358 169.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -77.38 131.32 37.99 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.466 1.106 . . . . 0.0 110.911 179.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 76.8 p -81.42 166.91 19.97 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 115.333 1.605 . . . . 0.0 115.333 -174.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 10.1 mp -67.29 114.5 6.05 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.103 0.961 . . . . 0.0 109.271 171.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.06 150.89 44.44 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -173.025 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -131.83 169.65 15.95 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 126.422 1.889 . . . . 0.0 112.442 178.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -110.89 139.66 46.03 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.078 1.351 . . . . 0.0 112.333 -177.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 59.6 tp -109.0 128.02 54.58 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 126.063 1.745 . . . . 0.0 108.938 168.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -118.77 117.01 27.74 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.494 1.518 . . . . 0.0 109.53 173.185 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 34.9 t -102.58 117.83 48.55 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 C-N-CA 124.347 1.059 . . . . 0.0 108.563 169.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 81.6 p -95.96 156.95 16.12 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.895 1.678 . . . . 0.0 111.304 -178.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -59.05 142.32 51.65 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.45 1.1 . . . . 0.0 113.224 -171.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? . . . . . 0 N--CA 1.467 0.385 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 172.805 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 6.4 t . . . . . 0 N--CA 1.471 0.598 0 CA-C-O 121.228 0.537 . . . . 0.0 112.206 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -148.07 116.74 6.66 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.997 2.119 . . . . 0.0 109.232 -175.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 73.0 m -140.82 160.65 57.77 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 124.621 1.168 . . . . 0.0 113.17 -169.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -71.53 156.34 97.09 Favored 'Cis proline' 0 C--N 1.352 0.75 0 CA-C-N 119.535 0.87 . . . . 0.0 111.305 -5.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.44 -20.09 64.16 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 176.029 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 36.2 tp -141.9 120.16 12.25 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.642 1.577 . . . . 0.0 108.874 169.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 62.1 tp -109.92 122.36 47.36 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.156 1.382 . . . . 0.0 108.98 169.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.2 t -106.25 123.8 61.2 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 172.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.5 m -128.05 176.23 8.1 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 124.828 1.251 . . . . 0.0 111.092 171.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 52.7 m -110.12 151.5 27.16 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.605 1.562 . . . . 0.0 110.519 175.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -54.33 125.16 18.26 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.906 1.282 . . . . 0.0 112.201 178.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 97.3 -9.16 64.97 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 127.224 2.345 . . . . 0.0 114.301 -174.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -81.38 160.53 24.07 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 119.927 1.863 . . . . 0.0 112.547 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -91.88 111.34 22.84 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.473 1.109 . . . . 0.0 109.302 172.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -96.52 118.64 33.45 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.098 0.959 . . . . 0.0 111.143 -175.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 28.5 m -123.08 125.26 44.86 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.566 0.746 . . . . 0.0 112.13 -173.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -101.76 159.55 15.23 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.909 1.683 . . . . 0.0 110.755 169.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 21.0 m -110.67 128.91 55.89 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.179 1.392 . . . . 0.0 110.037 174.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 42.5 t -115.06 150.89 35.2 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.916 1.687 . . . . 0.0 111.67 171.407 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 62.0 p -148.28 143.86 27.23 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.254 -0.904 . . . . 0.0 111.362 169.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.438 ' CD2' ' HB3' ' A' ' 125' ' ' ALA . 3.3 m-85 . . . . . 0 N--CA 1.471 0.583 0 C-N-CA 126.251 1.82 . . . . 0.0 114.677 -176.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 55.0 p90 . . . . . 0 CA--C 1.539 0.527 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 75.9 t -96.12 133.72 36.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 C-N-CA 125.636 1.574 . . . . 0.0 107.302 168.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.451 HD22 ' CG ' ' A' ' 106' ' ' PHE . 5.5 tp -99.3 147.6 25.02 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.714 1.206 . . . . 0.0 110.123 174.143 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 23.0 m120 -136.21 154.3 50.97 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.745 1.618 . . . . 0.0 111.382 -176.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 12.6 t90 -129.84 137.9 50.7 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.425 1.09 . . . . 0.0 111.787 177.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -134.02 145.73 49.72 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 -174.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 56.7 ttt85 -101.92 142.03 33.85 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.26 1.424 . . . . 0.0 107.883 166.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 29.6 mtp -88.25 144.34 26.5 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 118.657 0.662 . . . . 0.0 112.54 175.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 74.3 m -106.45 149.47 38.35 Favored Pre-proline 0 CA--C 1.545 0.755 0 C-N-CA 125.43 1.492 . . . . 0.0 111.161 173.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -68.37 -15.86 42.73 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 124.016 3.144 . . . . 0.0 114.013 -173.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 18.4 m -76.94 8.96 3.24 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.813 1.245 . . . . 0.0 113.027 172.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 58.1 t30 70.53 45.75 0.59 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 127.693 2.397 . . . . 0.0 111.507 -177.555 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -128.93 -179.53 5.15 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.56 1.544 . . . . 0.0 110.368 -179.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.7 p -142.2 152.52 43.21 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 126.02 1.728 . . . . 0.0 110.503 -175.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -131.05 131.89 44.57 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.515 1.126 . . . . 0.0 111.177 174.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -77.69 121.23 23.72 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.473 1.109 . . . . 0.0 110.89 -178.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 48.0 mt -94.27 -45.01 7.69 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.476 1.51 . . . . 0.0 111.82 -173.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -168.35 175.64 6.29 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.497 1.919 . . . . 0.0 110.565 -171.059 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -158.41 165.8 33.78 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.435 1.494 . . . . 0.0 111.57 -175.319 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -153.06 117.11 2.82 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 124.233 1.013 . . . . 0.0 111.39 172.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo . . . . . 0 C--N 1.35 0.63 0 CA-C-N 119.665 0.916 . . . . 0.0 111.981 -12.463 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 35.2 mtp-105 . . . . . 0 N--CA 1.47 0.556 0 N-CA-C 113.187 0.81 . . . . 0.0 113.187 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 99.6 m-85 -97.52 116.25 29.37 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.856 1.263 . . . . 0.0 109.908 -178.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -130.37 141.25 50.57 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.714 1.205 . . . . 0.0 111.332 -172.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 47.5 t -126.53 125.93 68.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 C-N-CA 125.085 1.354 . . . . 0.0 109.706 178.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 87.3 m -130.54 131.29 44.98 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.925 1.29 . . . . 0.0 110.674 -176.327 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -79.66 140.76 36.94 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.923 0.889 . . . . 0.0 111.91 176.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 27.1 mt -95.1 157.1 37.05 Favored Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 125.586 1.554 . . . . 0.0 111.67 178.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -70.76 -2.76 11.41 Favored 'Trans proline' 0 CA--C 1.542 0.915 0 C-N-CA 123.619 2.88 . . . . 0.0 114.177 175.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -70.24 -8.95 54.17 Favored 'General case' 0 CA--C 1.555 1.141 0 N-CA-C 114.109 1.152 . . . . 0.0 114.109 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 108.03 -33.95 5.94 Favored Glycine 0 N--CA 1.476 1.336 0 C-N-CA 125.903 1.716 . . . . 0.0 116.443 168.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.49 73.28 0.9 Allowed 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.453 1.627 . . . . 0.0 110.224 169.599 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -157.45 142.37 16.79 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 125.171 1.389 . . . . 0.0 109.34 -167.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . 0.451 ' CG ' HD22 ' A' ' 65' ' ' LEU . 31.3 m-85 -149.45 135.17 18.65 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.056 0.542 . . . . 0.0 111.724 -169.089 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -90.99 136.25 33.2 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.022 0.929 . . . . 0.0 111.129 169.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 32.9 mtt -121.22 106.03 11.12 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 126.063 1.745 . . . . 0.0 109.38 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 33.8 t -110.98 128.88 55.98 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.257 1.023 . . . . 0.0 113.416 -169.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 28.2 t -96.88 100.85 11.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 C-N-CA 125.865 1.666 . . . . 0.0 106.61 168.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 89.0 t -73.96 129.23 36.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 124.09 0.956 . . . . 0.0 109.924 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 60.57 57.02 2.88 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.137 1.375 . . . . 0.0 110.967 173.577 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.78 156.31 39.46 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.338 1.055 . . . . 0.0 113.211 -171.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 23.6 mtm180 -133.66 160.68 36.81 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 126.533 1.933 . . . . 0.0 109.716 -168.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 32.2 mtp85 -55.65 -27.49 50.15 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 120.03 1.286 . . . . 0.0 113.258 171.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -69.89 -20.67 63.37 Favored 'General case' 0 CA--C 1.553 1.084 0 N-CA-C 114.476 1.287 . . . . 0.0 114.476 172.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -83.24 -9.81 58.92 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 121.061 -1.024 . . . . 0.0 112.879 175.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 71.2 m -59.88 135.6 57.75 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 120.211 -1.555 . . . . 0.0 111.634 173.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 160.27 -172.75 36.77 Favored Glycine 0 CA--C 1.53 1.028 0 C-N-CA 124.529 1.062 . . . . 0.0 113.365 -179.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.0 m -91.13 140.92 29.36 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.802 0.841 . . . . 0.0 109.985 176.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 52.9 m-85 -133.82 160.17 38.44 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.232 1.813 . . . . 0.0 110.632 178.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -155.99 149.54 24.85 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 124.299 1.04 . . . . 0.0 112.684 175.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 36.7 t -89.57 158.64 17.56 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.149 1.38 . . . . 0.0 111.054 173.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -149.32 170.43 29.59 Favored Glycine 0 N--CA 1.471 1.026 0 C-N-CA 125.634 1.587 . . . . 0.0 112.282 174.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . 0.438 ' HB3' ' CD2' ' A' ' 56' ' ' PHE . . . -156.68 159.21 38.17 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 173.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 21.0 tt -140.8 135.6 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 125.846 1.658 . . . . 0.0 109.934 174.253 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 19.9 m -69.31 160.79 30.59 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.515 0.726 . . . . 0.0 112.821 -179.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.53 -15.88 63.73 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 115.421 1.637 . . . . 0.0 115.421 -173.518 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -78.68 149.09 74.06 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 124.776 1.23 . . . . 0.0 112.445 -177.253 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -67.68 -22.48 43.73 Favored 'Trans proline' 0 CA--C 1.54 0.775 0 C-N-CA 123.125 2.55 . . . . 0.0 113.09 -179.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -79.19 -2.95 43.34 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 114.687 1.365 . . . . 0.0 114.687 176.199 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.46 167.71 16.07 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.769 1.228 . . . . 0.0 113.319 -178.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 22.3 pt20 -146.8 161.3 40.96 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.207 1.803 . . . . 0.0 109.312 173.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 20.9 mt -77.65 118.9 25.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 O-C-N 121.609 -0.682 . . . . 0.0 111.126 -174.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -89.76 128.14 36.07 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.313 1.445 . . . . 0.0 109.426 168.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -87.12 145.39 26.46 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.347 1.059 . . . . 0.0 110.861 178.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 5.8 t -94.36 -166.8 1.55 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.44 1.096 . . . . 0.0 112.237 172.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -68.02 153.01 44.64 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.33 1.452 . . . . 0.0 111.676 174.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 25.7 mtp-105 -91.15 146.51 23.77 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 125.346 1.458 . . . . 0.0 110.906 172.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -143.0 150.03 39.09 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.269 1.427 . . . . 0.0 111.837 178.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -93.0 132.49 37.04 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.599 1.16 . . . . 0.0 111.818 177.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 48.1 tp -103.63 126.33 50.71 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 166.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 33.6 ttm180 -128.38 109.94 11.89 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 124.342 1.057 . . . . 0.0 109.01 -178.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 21.8 t -102.32 119.53 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 123.872 0.869 . . . . 0.0 108.727 178.041 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 70.1 p -93.36 147.72 22.68 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 126.064 1.746 . . . . 0.0 109.887 178.12 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 10.6 pm0 -57.43 150.23 19.02 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.741 0.817 . . . . 0.0 112.592 -179.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 47.2 ttt85 . . . . . 0 C--O 1.236 0.358 0 C-N-CA 124.079 0.952 . . . . 0.0 110.918 -168.312 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.2 t . . . . . 0 N--CA 1.471 0.603 0 CA-C-O 121.25 0.548 . . . . 0.0 112.126 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -144.97 115.31 7.56 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 126.415 1.886 . . . . 0.0 108.493 175.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 93.3 p -140.88 159.31 62.72 Favored Pre-proline 0 CA--C 1.55 0.954 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 -168.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -69.84 161.6 86.1 Favored 'Cis proline' 0 C--N 1.354 0.867 0 CA-C-N 119.488 0.853 . . . . 0.0 111.6 -6.088 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.68 -24.49 67.8 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.148 0.795 . . . . 0.0 113.148 176.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 46.4 tp -141.0 121.26 13.89 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.639 1.576 . . . . 0.0 108.784 169.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 57.0 tp -107.17 125.45 51.11 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.241 1.417 . . . . 0.0 109.078 171.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.4 t -109.61 123.54 65.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.089 0.956 . . . . 0.0 108.702 173.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 26.8 m -127.42 164.38 28.53 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 124.707 1.203 . . . . 0.0 111.451 172.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 51.9 m -90.66 149.43 22.09 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.272 1.029 . . . . 0.0 110.451 171.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -56.98 123.66 15.93 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.117 0.967 . . . . 0.0 111.834 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 87.92 3.53 79.83 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 126.106 1.812 . . . . 0.0 114.569 -175.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -92.27 157.6 16.57 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.487 1.644 . . . . 0.0 111.569 170.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -82.45 130.37 35.09 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.187 0.995 . . . . 0.0 110.635 177.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -112.9 124.72 53.25 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.787 1.235 . . . . 0.0 111.099 -178.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 28.4 m -129.76 125.4 35.75 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 119.184 0.902 . . . . 0.0 112.078 -176.437 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -100.41 151.26 21.74 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.697 1.599 . . . . 0.0 110.621 169.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 58.0 m -99.54 130.39 45.78 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.292 1.437 . . . . 0.0 109.112 173.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 44.5 t -125.06 143.51 50.88 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 126.242 1.817 . . . . 0.0 111.496 177.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 96.3 p -153.97 156.82 38.16 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.103 -0.998 . . . . 0.0 113.131 168.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 . . . . . 0 CA--C 1.536 0.406 0 C-N-CA 126.846 2.058 . . . . 0.0 111.25 178.607 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 34.7 p90 . . . . . 0 CA--C 1.543 0.711 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 21.4 t -107.83 134.1 50.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 125.848 1.659 . . . . 0.0 109.027 169.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -104.53 141.08 37.02 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.648 1.179 . . . . 0.0 109.282 168.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -137.7 158.04 45.2 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.471 1.508 . . . . 0.0 111.182 -170.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 10.0 t90 -129.09 138.02 51.59 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.417 1.087 . . . . 0.0 112.187 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -131.19 141.41 50.05 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.247 1.419 . . . . 0.0 112.977 -175.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 48.7 ttp180 -101.11 143.98 30.56 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.936 2.094 . . . . 0.0 108.718 169.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 36.8 mtp -93.65 141.86 28.0 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.854 0.752 . . . . 0.0 112.398 178.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.0 m -92.21 158.49 39.06 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 124.849 1.26 . . . . 0.0 111.709 175.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_exo -55.81 -33.44 88.2 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 123.949 3.099 . . . . 0.0 114.192 177.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 12.6 m -77.03 8.28 4.03 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.201 1.4 . . . . 0.0 113.821 177.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 60.3 t30 70.19 22.84 5.38 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 127.279 2.232 . . . . 0.0 113.259 -178.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 45.4 mt-30 -90.14 -176.73 4.95 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.423 1.089 . . . . 0.0 110.364 169.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.6 p -138.3 152.18 48.28 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.515 1.526 . . . . 0.0 111.165 -175.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -132.58 129.33 38.86 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 126.505 1.922 . . . . 0.0 110.155 -176.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 44.9 tttm -85.76 121.5 28.51 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.194 0.998 . . . . 0.0 111.252 -171.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 53.5 mt -97.6 -48.69 5.15 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.914 1.285 . . . . 0.0 113.124 -168.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -170.66 172.68 5.71 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.88 1.672 . . . . 0.0 110.972 -172.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.59 165.49 32.7 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.993 1.317 . . . . 0.0 112.629 -177.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -140.63 121.0 8.86 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 125.684 1.594 . . . . 0.0 109.822 170.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo . . . . . 0 C--N 1.351 0.694 0 CA-C-N 120.065 1.059 . . . . 0.0 112.96 -9.404 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 44.0 mtp-105 . . . . . 0 N--CA 1.476 0.838 0 N-CA-C 111.995 0.368 . . . . 0.0 111.995 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -92.46 130.4 38.14 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.978 1.311 . . . . 0.0 108.56 173.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -131.06 152.15 50.67 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.083 1.353 . . . . 0.0 111.374 -177.249 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 97.4 t -126.61 123.21 62.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 125.534 1.533 . . . . 0.0 108.88 175.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 95.8 m -122.77 126.95 48.47 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.326 1.05 . . . . 0.0 110.787 -177.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 3.2 tp-100 -76.18 134.72 39.83 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.645 1.578 . . . . 0.0 109.989 171.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 33.3 mt -90.29 164.39 27.62 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 124.054 0.942 . . . . 0.0 112.004 176.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -55.37 -21.28 28.93 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 123.872 3.048 . . . . 0.0 114.172 172.058 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -60.19 -26.16 66.14 Favored 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 176.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 89.84 -17.25 53.99 Favored Glycine 0 CA--C 1.535 1.32 0 C-N-CA 125.355 1.455 . . . . 0.0 114.602 173.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 5.3 ptt180 -152.44 73.54 1.03 Allowed 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 123.024 1.393 . . . . 0.0 109.178 169.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -169.92 137.54 1.65 Allowed 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 128.322 2.649 . . . . 0.0 107.304 -179.081 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -141.58 145.44 35.07 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 114.46 1.282 . . . . 0.0 114.46 -166.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 -102.53 121.22 41.94 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.044 1.338 . . . . 0.0 110.506 168.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -101.29 103.85 14.84 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 126.467 1.907 . . . . 0.0 107.948 176.369 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 14.8 m -114.52 121.88 44.84 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 114.136 1.162 . . . . 0.0 114.136 -167.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 12.8 t -88.59 118.04 33.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 C-N-CA 125.084 1.354 . . . . 0.0 107.509 168.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 98.0 t -78.86 117.31 24.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 124.25 1.02 . . . . 0.0 109.21 173.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 55.6 mtp180 48.37 76.92 0.11 Allowed 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 126.787 2.035 . . . . 0.0 111.876 178.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -69.77 138.17 52.53 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.422 1.089 . . . . 0.0 111.891 -176.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.78 161.16 17.88 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 126.235 1.814 . . . . 0.0 110.195 178.342 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 76.9 mtm180 -56.76 -23.07 40.28 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 114.387 1.255 . . . . 0.0 114.387 -178.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -65.16 -23.6 67.15 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 170.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -82.13 -16.84 48.52 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.226 1.01 . . . . 0.0 113.365 -178.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 49.8 m -59.59 134.67 57.23 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 119.743 1.156 . . . . 0.0 112.693 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 152.68 -169.12 31.75 Favored Glycine 0 N--CA 1.472 1.086 0 C-N-CA 124.812 1.196 . . . . 0.0 113.249 -174.119 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.0 m -93.12 147.49 22.82 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.314 1.046 . . . . 0.0 111.146 -178.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -141.52 159.49 42.1 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.804 2.041 . . . . 0.0 111.5 -177.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.0 pp -154.34 154.1 32.77 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.618 1.567 . . . . 0.0 111.152 172.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 29.5 p -102.13 157.7 16.7 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.305 0.642 . . . . 0.0 112.566 171.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -149.06 145.16 13.17 Favored Glycine 0 N--CA 1.472 1.075 0 C-N-CA 124.997 1.284 . . . . 0.0 113.89 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -125.38 159.26 32.25 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.971 1.309 . . . . 0.0 113.04 -173.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 16.9 tt -159.5 137.57 2.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 125.332 1.453 . . . . 0.0 111.176 178.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 17.8 m -70.92 161.45 31.03 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.143 0.977 . . . . 0.0 112.664 175.059 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 17.8 mt -77.04 -12.56 59.95 Favored 'General case' 0 N--CA 1.479 0.994 0 O-C-N 120.69 -1.256 . . . . 0.0 114.335 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -65.82 143.83 98.65 Favored Pre-proline 0 CA--C 1.552 1.041 0 C-N-CA 124.046 0.939 . . . . 0.0 112.377 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_exo -55.58 -27.67 61.21 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 123.782 2.988 . . . . 0.0 114.695 176.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -83.24 -1.61 53.56 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.719 1.208 . . . . 0.0 114.218 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -67.94 162.77 23.59 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.366 1.066 . . . . 0.0 113.474 -177.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.27 153.21 38.4 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.812 1.645 . . . . 0.0 108.814 178.004 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 64.9 mt -76.53 124.75 35.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 123.631 0.773 . . . . 0.0 111.828 -173.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -97.11 145.46 25.98 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.695 1.198 . . . . 0.0 108.116 165.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -130.16 148.96 52.05 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.461 1.028 . . . . 0.0 111.818 -179.059 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 4.9 t -94.51 -166.11 1.42 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.011 1.325 . . . . 0.0 113.126 -173.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 82.8 mt -64.68 155.3 33.93 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.615 1.566 . . . . 0.0 111.734 175.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 31.0 mtp-105 -89.38 139.22 30.73 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.548 1.139 . . . . 0.0 110.444 173.043 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -137.11 151.01 48.37 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.413 1.485 . . . . 0.0 111.419 178.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -103.85 137.76 41.4 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.428 1.091 . . . . 0.0 111.754 -177.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 63.1 tp -106.14 128.97 54.27 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 125.747 1.619 . . . . 0.0 108.905 169.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 71.4 ttt180 -120.52 118.24 29.71 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.516 1.527 . . . . 0.0 109.399 171.268 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 32.8 t -102.17 119.44 50.48 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 C-N-CA 124.494 1.118 . . . . 0.0 108.432 170.21 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 63.0 p -99.66 144.77 28.36 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.526 1.531 . . . . 0.0 110.078 179.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -62.82 145.07 55.86 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.795 -0.566 . . . . 0.0 112.459 -174.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 46.9 ttt85 . . . . . 0 N--CA 1.468 0.427 0 C-N-CA 124.196 0.999 . . . . 0.0 110.857 -171.476 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.0 t . . . . . 0 N--CA 1.471 0.59 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.407 ' CD1' ' SG ' ' A' ' 123' ' ' CYS . 1.4 m-85 -127.39 141.95 51.55 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.143 0.977 . . . . 0.0 112.048 -168.202 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 95.9 p -141.08 159.39 61.89 Favored Pre-proline 0 CA--C 1.548 0.9 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 177.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -73.15 161.54 93.69 Favored 'Cis proline' 0 C--N 1.353 0.802 0 CA-C-N 118.925 0.652 . . . . 0.0 111.096 -11.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.5 -29.44 70.55 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 171.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 49.1 tp -140.53 121.93 15.01 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.82 1.648 . . . . 0.0 109.453 171.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 56.5 tp -104.81 126.68 52.13 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.74 1.616 . . . . 0.0 109.068 171.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 18.3 t -110.18 125.45 67.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 123.999 0.92 . . . . 0.0 108.533 171.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.1 m -129.47 165.14 30.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 124.671 1.188 . . . . 0.0 111.653 174.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 88.5 m -92.12 148.6 22.05 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.295 1.038 . . . . 0.0 109.849 171.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -56.23 123.8 15.78 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.987 0.915 . . . . 0.0 112.076 -177.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 93.58 -2.98 71.03 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 125.421 1.486 . . . . 0.0 114.74 -175.443 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -71.16 153.24 42.65 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.624 1.712 . . . . 0.0 111.461 169.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -84.28 106.53 15.97 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 169.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -94.25 123.18 37.49 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.863 0.865 . . . . 0.0 110.928 -172.047 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 42.0 m -131.63 126.83 35.69 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 119.051 0.841 . . . . 0.0 112.313 -170.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -98.29 156.74 16.57 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 126.139 1.776 . . . . 0.0 110.506 170.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.8 m -105.64 129.74 53.82 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.834 1.254 . . . . 0.0 109.18 171.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 67.8 m -115.84 124.4 50.59 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.58 1.152 . . . . 0.0 109.104 169.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 73.1 m -121.55 126.37 49.0 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 124.748 1.219 . . . . 0.0 110.075 -170.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 10.9 p90 . . . . . 0 CA--C 1.539 0.548 0 C-N-CA 124.961 1.304 . . . . 0.0 110.583 177.237 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 53.1 p90 . . . . . 0 CA--C 1.541 0.607 0 CA-C-O 121.284 0.564 . . . . 0.0 112.283 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 17.6 t -125.42 133.68 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 125.744 1.617 . . . . 0.0 107.786 168.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -105.89 136.17 46.02 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.138 1.375 . . . . 0.0 108.913 173.552 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -126.82 150.96 48.92 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.119 1.367 . . . . 0.0 111.502 178.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 14.0 t90 -127.59 138.93 53.01 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.242 1.417 . . . . 0.0 111.847 178.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -134.74 151.31 50.88 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.612 1.565 . . . . 0.0 113.815 -171.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -112.08 141.19 46.07 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.556 1.542 . . . . 0.0 109.328 168.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 84.5 mmm -73.79 137.73 44.06 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.473 0.709 . . . . 0.0 111.642 174.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 67.7 m -94.26 156.6 38.68 Favored Pre-proline 0 CA--C 1.548 0.882 0 C-N-CA 124.723 1.209 . . . . 0.0 111.57 170.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -55.65 -32.74 84.76 Favored 'Trans proline' 0 C--N 1.354 0.857 0 C-N-CA 124.038 3.159 . . . . 0.0 114.648 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.3 m -76.99 5.73 7.52 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.804 1.241 . . . . 0.0 113.835 178.113 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 72.93 21.01 3.38 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 127.843 2.457 . . . . 0.0 112.98 -175.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -90.41 -175.08 4.36 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.589 1.156 . . . . 0.0 110.314 170.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.9 p -139.02 145.26 39.42 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 125.618 1.567 . . . . 0.0 110.024 -175.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -121.27 131.48 54.24 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.165 0.986 . . . . 0.0 111.193 176.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -80.97 123.07 28.03 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.237 1.415 . . . . 0.0 110.773 -175.012 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 45.5 mt -100.94 -53.54 3.02 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.864 1.266 . . . . 0.0 112.2 -168.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -161.16 167.28 26.46 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.273 1.829 . . . . 0.0 110.014 -169.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.63 166.85 29.8 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.974 0.91 . . . . 0.0 112.292 -172.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 74.1 t80 -144.99 114.57 4.99 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 124.511 1.124 . . . . 0.0 110.558 170.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo . . . . . 0 C--N 1.351 0.671 0 CA-C-N 119.772 0.954 . . . . 0.0 112.567 -11.339 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 . . . . . 0 N--CA 1.475 0.784 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -95.8 140.94 29.86 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.427 1.091 . . . . 0.0 112.161 -168.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 58.9 ttt180 -144.54 147.27 33.01 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.11 1.364 . . . . 0.0 112.081 176.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 84.7 t -115.72 126.74 73.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 126.176 1.791 . . . . 0.0 108.763 170.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 98.5 m -130.51 132.29 45.55 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.361 1.464 . . . . 0.0 110.39 -177.276 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -77.68 138.47 39.09 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.09 0.556 . . . . 0.0 110.231 172.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 20.2 mt -76.85 156.44 82.55 Favored Pre-proline 0 CA--C 1.544 0.743 0 O-C-N 121.704 -0.622 . . . . 0.0 111.788 171.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -66.46 -6.4 15.03 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.504 2.802 . . . . 0.0 113.44 172.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -60.04 -26.09 65.85 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 124.086 0.955 . . . . 0.0 112.98 169.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 88.28 -10.58 70.69 Favored Glycine 0 CA--C 1.534 1.246 0 C-N-CA 125.079 1.323 . . . . 0.0 115.041 178.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 32.6 ptt180 -154.58 73.61 0.91 Allowed 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 118.76 1.28 . . . . 0.0 111.533 173.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -178.76 148.37 0.42 Allowed 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 128.157 2.583 . . . . 0.0 108.912 -177.388 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -138.01 146.6 43.27 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.793 0.837 . . . . 0.0 112.925 -177.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 6.6 m170 -109.2 131.26 55.24 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.033 1.733 . . . . 0.0 111.537 169.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -114.06 105.1 12.81 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 126.706 2.002 . . . . 0.0 107.762 -176.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 38.2 p -115.1 133.14 56.3 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 -168.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 15.4 t -96.25 104.71 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 126.772 2.029 . . . . 0.0 106.91 168.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 95.8 t -74.52 114.8 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 124.537 1.135 . . . . 0.0 108.742 177.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 10.1 mpt_? 55.34 84.96 0.07 Allowed 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 126.257 1.823 . . . . 0.0 111.317 -173.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -73.76 118.23 16.46 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.744 0.817 . . . . 0.0 111.213 178.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 9.4 mpt_? -85.82 159.86 19.61 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.41 1.484 . . . . 0.0 109.383 171.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 17.1 mmm180 -49.2 -39.17 28.53 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 120.937 -1.102 . . . . 0.0 113.011 172.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -67.36 -10.07 47.55 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 178.011 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -84.6 -8.45 58.89 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 120.107 1.321 . . . . 0.0 112.871 172.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.4 m -64.35 136.69 57.38 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 120.155 -1.59 . . . . 0.0 112.438 177.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 155.24 -166.74 32.72 Favored Glycine 0 N--CA 1.468 0.786 0 C-N-CA 124.101 0.858 . . . . 0.0 113.016 -178.462 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.0 m -97.26 140.42 31.77 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.525 1.13 . . . . 0.0 110.803 -176.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -135.73 163.0 31.17 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.3 1.84 . . . . 0.0 112.175 -177.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -162.13 146.62 12.46 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.568 1.547 . . . . 0.0 112.589 171.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . 0.407 ' SG ' ' CD1' ' A' ' 37' ' ' PHE . 1.8 p -108.54 170.69 7.86 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.038 1.735 . . . . 0.0 111.026 176.247 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -175.35 142.37 6.16 Favored Glycine 0 N--CA 1.471 1.026 0 O-C-N 121.237 -0.915 . . . . 0.0 114.184 177.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -109.73 148.2 31.84 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.567 1.147 . . . . 0.0 112.765 -176.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 21.3 tt -138.01 143.7 32.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 126.667 1.987 . . . . 0.0 110.078 177.125 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.7 m -67.5 161.56 25.2 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.871 0.868 . . . . 0.0 112.835 176.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -59.02 -25.74 63.94 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 115.223 1.564 . . . . 0.0 115.223 178.038 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -81.73 148.13 60.76 Favored Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 124.876 1.27 . . . . 0.0 112.52 -174.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -69.91 -24.97 28.4 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 123.261 2.64 . . . . 0.0 114.107 -171.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.3 -0.97 30.89 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.84 1.422 . . . . 0.0 114.84 178.517 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.79 173.95 5.71 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.512 1.525 . . . . 0.0 113.196 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 53.8 tp60 -134.99 143.84 47.05 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.114 1.766 . . . . 0.0 109.171 179.041 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 53.7 mt -72.45 114.84 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 170.419 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -85.13 112.74 20.96 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.396 1.079 . . . . 0.0 111.027 -178.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -90.67 158.88 16.68 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.033 1.733 . . . . 0.0 112.048 -177.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 4.9 t -145.98 -166.85 2.57 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.994 0.918 . . . . 0.0 111.799 169.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.88 136.55 57.03 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.727 1.211 . . . . 0.0 113.094 -172.685 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 80.0 mtt85 -72.43 146.33 47.03 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.709 0.804 . . . . 0.0 111.529 -177.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -120.78 135.58 55.12 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.064 1.745 . . . . 0.0 110.688 -176.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -104.42 139.28 39.59 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.341 1.056 . . . . 0.0 111.728 -175.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 52.5 tp -109.62 127.91 54.86 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.8 1.64 . . . . 0.0 109.659 171.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 60.7 ttt85 -118.25 119.29 34.21 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.678 1.591 . . . . 0.0 109.179 170.127 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 43.6 t -102.0 123.15 55.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 171.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 68.6 p -99.0 145.47 27.04 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.566 1.546 . . . . 0.0 109.208 175.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -66.43 141.81 57.8 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 121.54 -0.725 . . . . 0.0 111.754 -175.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 . . . . . 0 N--CA 1.468 0.444 0 C-N-CA 124.186 0.994 . . . . 0.0 110.598 -179.033 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 15.3 t . . . . . 0 N--CA 1.476 0.861 0 CA-C-O 120.973 0.416 . . . . 0.0 111.639 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.408 ' CE1' ' HB2' ' A' ' 123' ' ' CYS . 1.9 m-85 -125.0 136.61 53.89 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.405 1.482 . . . . 0.0 110.714 -169.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 88.7 p -140.96 157.24 67.72 Favored Pre-proline 0 CA--C 1.548 0.894 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 177.639 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -70.37 160.59 89.59 Favored 'Cis proline' 0 C--N 1.352 0.716 0 CA-C-N 119.0 0.679 . . . . 0.0 110.887 -11.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.46 -30.71 69.84 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 172.284 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 49.8 tp -140.32 120.68 14.0 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.569 1.548 . . . . 0.0 109.358 171.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 61.0 tp -102.83 127.02 50.17 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.45 1.5 . . . . 0.0 109.171 172.129 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.6 t -109.7 124.9 66.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 123.902 0.881 . . . . 0.0 108.811 171.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.2 m -127.17 169.91 17.88 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 124.639 1.176 . . . . 0.0 111.551 172.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 94.5 m -100.66 147.28 26.16 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.043 1.337 . . . . 0.0 110.058 173.101 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -59.27 126.6 28.33 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.178 0.991 . . . . 0.0 111.823 -174.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 91.65 -2.84 77.7 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 125.993 1.759 . . . . 0.0 114.473 -174.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 38.3 t0 -83.35 156.84 22.8 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.841 1.821 . . . . 0.0 112.004 173.267 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -79.21 123.75 27.7 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.567 0.747 . . . . 0.0 109.806 170.175 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -102.66 129.4 49.24 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 117.68 -1.152 . . . . 0.0 110.567 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 31.3 m -132.79 129.65 38.84 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 119.377 0.99 . . . . 0.0 112.222 -177.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -106.21 159.62 15.96 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 127.625 2.37 . . . . 0.0 110.731 169.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 85.9 m -109.76 134.72 51.7 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.5 1.52 . . . . 0.0 109.108 170.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 64.2 m -131.55 125.74 33.09 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.981 1.312 . . . . 0.0 110.237 172.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 91.2 p -104.29 148.17 26.67 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.099 0.96 . . . . 0.0 110.817 175.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 . . . . . 0 N--CA 1.466 0.325 0 C-N-CA 124.852 1.261 . . . . 0.0 112.347 178.056 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 35.0 p90 . . . . . 0 CA--C 1.543 0.688 0 CA-C-O 120.42 0.152 . . . . 0.0 111.318 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 50.6 t -95.87 124.34 48.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 N-CA-C 107.559 -1.274 . . . . 0.0 107.559 170.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.58 HD11 ' HE1' ' A' ' 108' ' ' MET . 2.2 tm? -99.33 141.76 31.68 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 126.655 1.982 . . . . 0.0 108.896 177.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -141.96 154.91 45.39 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.932 1.693 . . . . 0.0 111.258 -175.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 20.3 t90 -128.2 143.0 51.0 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.944 1.298 . . . . 0.0 111.395 175.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -138.13 148.3 44.79 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.818 1.247 . . . . 0.0 114.164 -170.356 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 53.5 ttt-85 -109.19 143.19 38.93 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.234 1.414 . . . . 0.0 109.65 168.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 85.7 mmm -75.38 135.07 40.82 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 118.333 0.515 . . . . 0.0 111.368 173.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.2 p -85.7 165.64 34.06 Favored Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 123.478 0.711 . . . . 0.0 112.429 172.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -58.62 -28.31 85.65 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 123.45 2.767 . . . . 0.0 113.498 170.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.7 m -83.52 0.96 44.24 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.874 1.27 . . . . 0.0 113.277 175.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 74.05 21.71 2.51 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 127.613 2.365 . . . . 0.0 113.429 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 18.7 mm100 -87.42 -178.96 6.28 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.71 0.804 . . . . 0.0 110.393 169.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.8 p -126.83 119.35 26.62 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.94 1.696 . . . . 0.0 109.388 -173.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -104.07 128.62 51.7 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.717 0.807 . . . . 0.0 111.199 -179.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -76.53 127.62 33.18 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.045 0.938 . . . . 0.0 112.065 -172.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 66.2 mt -106.75 -44.35 4.47 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 125.343 1.457 . . . . 0.0 112.406 -169.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -166.97 169.71 12.75 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.479 1.912 . . . . 0.0 110.432 -176.1 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.56 165.77 32.18 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.645 1.178 . . . . 0.0 112.76 -171.134 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 75.0 t80 -147.49 123.0 5.29 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 125.388 1.475 . . . . 0.0 110.533 170.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo . . . . . 0 C--N 1.351 0.665 0 CA-C-N 120.126 1.081 . . . . 0.0 111.94 -10.68 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 48.5 mtp180 . . . . . 0 N--CA 1.473 0.701 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -88.63 142.38 27.74 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.368 1.067 . . . . 0.0 111.388 176.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 48.6 mtm180 -143.0 154.16 43.71 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.054 1.341 . . . . 0.0 112.79 -172.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 37.6 t -126.49 134.05 67.25 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 126.392 1.877 . . . . 0.0 108.702 168.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 95.3 m -123.91 126.06 45.71 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.262 1.425 . . . . 0.0 108.666 169.325 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 6.8 pm0 -83.62 141.56 31.45 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.322 1.049 . . . . 0.0 111.146 174.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 18.1 mt -87.81 156.25 52.72 Favored Pre-proline 0 CA--C 1.542 0.668 0 C-N-CA 123.685 0.794 . . . . 0.0 111.526 178.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -66.43 -4.61 11.05 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 123.361 2.708 . . . . 0.0 114.148 176.163 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -71.83 -10.5 59.87 Favored 'General case' 0 CA--C 1.551 1.015 0 CA-C-N 119.895 1.225 . . . . 0.0 113.281 171.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 92.15 -19.43 49.58 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 125.775 1.655 . . . . 0.0 116.024 169.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 11.9 ptp180 -154.63 73.65 0.91 Allowed 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 122.736 1.255 . . . . 0.0 110.842 173.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -167.43 144.77 4.53 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 128.7 2.8 . . . . 0.0 107.834 -176.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -146.66 147.52 31.11 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 113.82 1.044 . . . . 0.0 113.82 -168.3 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 51.6 m170 -109.0 127.93 54.51 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.827 1.651 . . . . 0.0 109.758 168.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.58 ' HE1' HD11 ' A' ' 65' ' ' LEU . 1.1 mpt? -113.52 126.74 55.65 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 126.253 1.821 . . . . 0.0 108.592 -176.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 93.7 p -142.67 149.06 38.38 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 116.841 2.163 . . . . 0.0 116.841 -171.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 11.1 t -103.41 122.44 55.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 126.849 2.059 . . . . 0.0 108.684 174.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 86.3 t -73.59 120.98 23.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 124.382 1.073 . . . . 0.0 109.675 169.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 49.3 72.61 0.29 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 126.006 1.722 . . . . 0.0 111.807 172.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.58 135.4 52.85 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.367 1.067 . . . . 0.0 111.954 -172.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -102.88 157.8 16.72 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 126.312 1.845 . . . . 0.0 109.937 175.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 74.9 mtm180 -52.47 -30.39 29.59 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 175.388 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 32.1 t30 -63.14 -24.74 68.03 Favored 'General case' 0 CA--C 1.551 1.009 0 N-CA-C 114.927 1.455 . . . . 0.0 114.927 173.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -74.82 -21.19 59.42 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 119.811 1.187 . . . . 0.0 112.87 -179.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 17.6 m -57.65 131.86 51.53 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.552 1.141 . . . . 0.0 113.198 -175.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 156.64 -165.92 33.17 Favored Glycine 0 CA--C 1.529 0.961 0 C-N-CA 124.523 1.059 . . . . 0.0 113.157 -172.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.4 m -93.25 143.01 26.68 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.058 1.343 . . . . 0.0 111.139 -175.284 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 61.9 m-85 -140.81 157.3 45.59 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.702 1.601 . . . . 0.0 111.515 -177.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.6 pp -154.98 156.24 35.65 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.285 1.034 . . . . 0.0 111.857 173.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . 0.408 ' HB2' ' CE1' ' A' ' 37' ' ' PHE . 79.6 m -101.77 162.38 12.95 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.002 0.921 . . . . 0.0 110.741 173.539 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -155.11 158.83 28.65 Favored Glycine 0 N--CA 1.47 0.929 0 O-C-N 121.473 -0.767 . . . . 0.0 112.98 173.314 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -146.98 156.7 43.26 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 117.952 0.876 . . . . 0.0 112.766 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.0 tt -146.98 134.39 14.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 124.829 1.252 . . . . 0.0 110.983 -175.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 48.2 t -61.84 158.18 16.52 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.045 0.938 . . . . 0.0 113.068 178.666 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 68.4 mt -72.95 -12.61 61.01 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.26 1.024 . . . . 0.0 112.949 176.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -67.43 143.95 97.56 Favored Pre-proline 0 CA--C 1.554 1.1 0 C-N-CA 124.451 1.1 . . . . 0.0 112.583 177.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_exo -57.33 -30.77 88.94 Favored 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 123.624 2.883 . . . . 0.0 114.846 177.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -87.93 7.23 31.89 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 124.687 1.195 . . . . 0.0 114.163 -176.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.78 165.99 14.06 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.928 1.291 . . . . 0.0 114.319 -175.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 31.2 tt0 -146.49 149.88 34.5 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.215 1.806 . . . . 0.0 109.116 178.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 56.1 mt -73.39 124.64 30.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 123.377 0.671 . . . . 0.0 111.112 -176.002 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -84.81 142.99 29.38 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.037 1.735 . . . . 0.0 110.904 172.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -142.79 158.89 43.18 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.978 1.711 . . . . 0.0 110.638 -175.325 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 5.5 t -144.12 -171.57 3.59 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.424 1.09 . . . . 0.0 111.947 175.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -63.25 125.23 23.42 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.182 1.393 . . . . 0.0 110.585 -176.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -65.56 163.77 15.48 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 -173.15 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.96 168.21 10.27 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.021 2.129 . . . . 0.0 111.317 175.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -131.52 142.95 50.06 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.883 1.273 . . . . 0.0 111.623 177.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 66.1 tp -109.87 133.81 52.75 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 125.954 1.701 . . . . 0.0 109.883 170.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 72.0 ttt180 -123.94 120.14 31.64 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.676 1.59 . . . . 0.0 108.986 169.055 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 44.4 t -104.19 120.34 54.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 170.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 67.2 p -98.22 148.75 23.28 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.234 1.814 . . . . 0.0 109.521 177.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -64.02 151.01 44.07 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.313 -0.867 . . . . 0.0 113.226 -172.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 48.3 ttt85 . . . . . 0 C--O 1.236 0.359 0 C-N-CA 123.953 0.901 . . . . 0.0 108.638 -173.935 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 6.0 t . . . . . 0 N--CA 1.471 0.622 0 CA-C-O 120.502 0.192 . . . . 0.0 111.44 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.46 ' CD2' ' HB2' ' A' ' 123' ' ' CYS . 0.9 OUTLIER -160.28 157.86 28.82 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 125.943 1.697 . . . . 0.0 113.243 176.708 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 95.1 p -140.78 158.74 64.72 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 125.163 1.385 . . . . 0.0 112.568 174.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -73.48 160.88 95.18 Favored 'Cis proline' 0 C--N 1.351 0.686 0 CA-C-N 118.485 0.495 . . . . 0.0 111.311 -9.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.75 -30.58 71.59 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 171.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 45.9 tp -136.79 117.67 14.17 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.947 1.699 . . . . 0.0 109.046 171.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.2 tp -100.69 127.36 47.12 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.43 1.492 . . . . 0.0 109.439 174.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.0 t -109.99 124.2 66.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 123.979 0.911 . . . . 0.0 108.809 172.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.4 m -127.86 167.06 23.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 124.916 1.286 . . . . 0.0 111.595 172.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 67.1 m -93.4 148.49 22.02 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.485 1.114 . . . . 0.0 110.145 174.624 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -53.93 119.9 5.64 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.885 1.274 . . . . 0.0 111.708 177.359 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 94.59 -3.28 68.22 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 126.104 1.812 . . . . 0.0 114.886 -177.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -88.83 155.18 19.7 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 119.281 1.54 . . . . 0.0 111.582 174.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -80.82 134.61 35.81 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.292 -0.88 . . . . 0.0 111.437 173.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -107.22 131.75 53.83 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.13 1.772 . . . . 0.0 110.592 178.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 28.6 m -132.75 125.09 29.37 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.846 0.858 . . . . 0.0 111.302 -179.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -101.49 153.23 19.89 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.249 1.42 . . . . 0.0 110.357 169.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 66.9 m -117.05 117.67 30.27 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.213 1.005 . . . . 0.0 110.166 178.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 21.6 m -101.0 151.12 22.16 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.699 1.2 . . . . 0.0 113.157 169.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 70.3 m -127.05 115.42 19.17 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.01 1.324 . . . . 0.0 109.207 174.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 . . . . . 0 N--CA 1.468 0.471 0 C-N-CA 126.291 1.837 . . . . 0.0 110.083 -178.27 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 24.4 p90 . . . . . 0 CA--C 1.538 0.496 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 45.7 t -110.85 134.0 54.53 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 C-N-CA 127.076 2.15 . . . . 0.0 107.847 171.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 30.8 tp -109.17 134.14 52.11 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.324 0.65 . . . . 0.0 110.087 169.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -124.96 148.98 48.13 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.505 1.522 . . . . 0.0 111.241 -169.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 34.6 t-105 -110.22 138.83 46.07 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.4 1.48 . . . . 0.0 111.665 175.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -132.99 146.03 51.4 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.1 1.36 . . . . 0.0 112.441 -177.07 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 38.5 ttp180 -91.7 136.59 33.02 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.693 1.597 . . . . 0.0 107.541 167.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 16.6 ttm -111.44 133.14 53.95 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.972 1.309 . . . . 0.0 110.206 -179.168 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 51.0 m -85.62 160.61 53.07 Favored Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 125.301 1.44 . . . . 0.0 112.391 179.046 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_exo -58.56 -26.39 78.46 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 124.237 3.291 . . . . 0.0 114.136 174.36 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.9 p -76.95 1.32 18.06 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.891 1.677 . . . . 0.0 113.643 174.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 30.5 m-80 69.81 20.98 6.59 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 127.635 2.374 . . . . 0.0 112.786 -176.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -85.84 169.85 12.94 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.637 0.775 . . . . 0.0 110.364 169.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.7 p -138.92 152.48 47.77 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.967 1.307 . . . . 0.0 111.974 -173.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -136.9 131.11 32.66 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.362 1.865 . . . . 0.0 110.296 -178.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -85.05 129.27 34.83 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.16 0.984 . . . . 0.0 111.96 -173.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 55.5 mt -107.44 -57.1 2.13 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.282 1.033 . . . . 0.0 110.892 -172.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -162.18 173.84 13.73 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.526 1.13 . . . . 0.0 111.286 -173.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.62 172.17 18.28 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.104 1.361 . . . . 0.0 111.639 -177.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 45.6 t80 -138.46 118.36 9.79 Favored Pre-proline 0 CA--C 1.546 0.791 0 CA-C-O 118.507 -0.759 . . . . 0.0 110.521 168.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo . . . . . 0 C--N 1.353 0.768 0 CA-C-N 119.375 0.813 . . . . 0.0 111.153 -8.8 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.3 ptm180 . . . . . 0 N--CA 1.468 0.461 0 N-CA-C 116.72 2.119 . . . . 0.0 116.72 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -103.63 117.23 33.93 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.831 1.252 . . . . 0.0 109.751 176.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 15.8 mmt180 -144.43 155.51 43.78 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.697 0.799 . . . . 0.0 112.277 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 31.1 t -126.56 140.39 49.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 C-N-CA 125.085 1.354 . . . . 0.0 110.582 176.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 96.3 m -130.63 134.28 46.84 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 125.474 1.509 . . . . 0.0 111.098 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -78.79 135.33 37.06 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.997 1.319 . . . . 0.0 109.967 169.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 21.5 mt -82.11 159.29 65.63 Favored Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 124.187 0.995 . . . . 0.0 112.386 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -64.2 -6.89 12.39 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 123.301 2.667 . . . . 0.0 114.287 174.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -73.85 -7.65 53.03 Favored 'General case' 0 CA--C 1.551 1.017 0 CA-C-N 120.022 1.283 . . . . 0.0 113.261 170.009 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 83.49 -14.07 43.03 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 125.518 1.532 . . . . 0.0 116.092 169.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.57 73.52 0.91 Allowed 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 123.103 1.43 . . . . 0.0 111.341 172.085 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -171.47 145.41 2.08 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 128.482 2.713 . . . . 0.0 108.186 -176.356 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -142.96 141.68 31.48 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -168.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 23.0 m170 -102.57 130.34 49.4 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.598 1.559 . . . . 0.0 110.806 169.024 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -114.77 111.54 21.4 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.974 1.71 . . . . 0.0 108.621 179.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 32.4 m -110.37 130.46 55.55 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.623 1.169 . . . . 0.0 112.935 -168.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 34.0 t -110.47 101.41 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 126.889 2.076 . . . . 0.0 107.112 168.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 70.9 t -74.32 133.87 30.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 123.785 0.834 . . . . 0.0 110.266 -178.361 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 39.1 ttm180 57.2 62.84 2.06 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.911 1.284 . . . . 0.0 110.737 172.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.41 135.38 47.22 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 124.475 1.11 . . . . 0.0 111.173 -175.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.98 167.31 10.49 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.29 1.436 . . . . 0.0 111.026 175.336 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 12.2 mtp180 -58.86 -23.02 60.26 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 113.915 1.079 . . . . 0.0 113.915 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -69.34 -21.98 63.79 Favored 'General case' 0 CA--C 1.553 1.07 0 N-CA-C 114.104 1.15 . . . . 0.0 114.104 170.501 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -77.23 -20.12 55.68 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 119.771 1.169 . . . . 0.0 113.565 174.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 49.1 m -57.29 129.22 40.8 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 119.86 1.209 . . . . 0.0 112.358 -178.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 154.55 -166.71 32.35 Favored Glycine 0 N--CA 1.471 0.991 0 C-N-CA 124.218 0.913 . . . . 0.0 113.421 -171.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.3 m -91.01 143.64 26.5 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.436 1.094 . . . . 0.0 110.998 -175.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -140.73 158.06 44.52 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.637 1.975 . . . . 0.0 110.619 176.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.4 pp -158.03 166.48 32.43 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 120.839 -1.163 . . . . 0.0 113.466 -178.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . 0.46 ' HB2' ' CD2' ' A' ' 37' ' ' PHE . 0.1 OUTLIER -114.19 135.89 53.55 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.226 1.81 . . . . 0.0 110.697 -174.585 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -138.99 130.37 4.83 Favored Glycine 0 N--CA 1.472 1.072 0 C-N-CA 123.997 0.808 . . . . 0.0 113.276 179.186 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -102.72 155.07 18.56 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.75 1.22 . . . . 0.0 112.725 -176.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 19.2 tt -155.93 144.52 12.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 125.339 1.455 . . . . 0.0 109.57 176.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 2.2 m -65.27 161.58 19.15 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 121.045 -1.035 . . . . 0.0 112.971 178.505 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 59.2 tp -60.58 -34.66 74.52 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.112 0.965 . . . . 0.0 112.154 169.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -66.83 127.88 93.64 Favored Pre-proline 0 CA--C 1.554 1.133 0 C-N-CA 124.481 1.112 . . . . 0.0 111.891 178.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -56.69 -24.59 55.59 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 124.108 3.205 . . . . 0.0 115.834 -178.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -70.6 -6.45 36.75 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 178.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.06 173.23 5.69 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.458 1.503 . . . . 0.0 114.103 -178.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -140.5 161.77 36.93 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.215 1.806 . . . . 0.0 109.668 174.481 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 28.4 mt -82.7 124.36 39.31 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 CA-C-O 121.174 0.511 . . . . 0.0 111.44 -169.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -91.41 127.31 36.8 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.342 1.857 . . . . 0.0 110.178 171.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -137.25 139.1 40.76 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.101 1.36 . . . . 0.0 111.041 -178.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 57.5 m -147.74 143.51 27.62 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.812 1.645 . . . . 0.0 110.063 171.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 42.6 mt 66.84 -178.55 0.21 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 126.978 2.111 . . . . 0.0 113.526 176.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.4 145.73 20.63 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.243 1.817 . . . . 0.0 110.572 169.656 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.86 165.09 13.48 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.829 1.652 . . . . 0.0 110.897 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -127.35 136.09 51.41 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 124.392 1.077 . . . . 0.0 110.23 -171.3 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 62.5 tp -110.36 131.89 54.66 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 125.554 1.541 . . . . 0.0 109.598 174.117 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 70.8 ttt180 -122.86 120.97 35.06 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.717 1.607 . . . . 0.0 109.566 170.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 28.7 t -104.41 118.22 51.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 C-N-CA 124.429 1.092 . . . . 0.0 109.026 170.155 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 71.9 p -98.5 155.71 17.13 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.738 1.615 . . . . 0.0 110.935 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -64.45 141.24 58.84 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 121.61 0.719 . . . . 0.0 112.347 -177.219 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 26.0 ttp-105 . . . . . 0 N--CA 1.466 0.362 0 C-N-CA 125.133 1.373 . . . . 0.0 110.166 179.279 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 91.8 m . . . . . 0 N--CA 1.47 0.564 0 CA-C-O 121.152 0.501 . . . . 0.0 110.463 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 50.6 t80 -145.47 118.88 9.0 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.225 1.81 . . . . 0.0 109.27 175.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 71.7 m -140.77 159.97 60.48 Favored Pre-proline 0 N--CA 1.477 0.886 0 C-N-CA 124.306 1.042 . . . . 0.0 113.352 -168.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -70.03 156.69 93.39 Favored 'Cis proline' 0 C--N 1.354 0.832 0 CA-C-N 119.723 0.937 . . . . 0.0 111.415 -4.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.03 -21.92 64.06 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 176.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 51.5 tp -143.68 121.68 12.09 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.311 1.444 . . . . 0.0 108.876 169.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 49.7 tp -111.12 126.96 55.39 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.536 1.534 . . . . 0.0 109.264 173.233 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 40.3 t -115.78 120.08 63.74 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 124.219 1.008 . . . . 0.0 108.927 176.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 26.9 m -123.64 166.97 18.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 125.57 1.548 . . . . 0.0 111.72 174.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 24.4 m -90.95 151.11 21.21 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.796 1.238 . . . . 0.0 110.701 174.227 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -51.73 124.87 13.42 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.246 1.418 . . . . 0.0 111.56 174.069 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.57 -1.36 88.9 Favored Glycine 0 CA--C 1.533 1.213 0 C-N-CA 125.487 1.517 . . . . 0.0 114.849 -177.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -88.67 162.13 16.47 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 119.421 1.61 . . . . 0.0 111.808 175.28 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -89.89 136.44 33.04 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.192 0.997 . . . . 0.0 110.65 176.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -116.79 135.95 53.35 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.255 1.422 . . . . 0.0 110.95 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 22.4 m -132.72 124.26 27.83 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 118.945 0.793 . . . . 0.0 111.869 178.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -100.79 159.56 15.09 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.648 1.579 . . . . 0.0 110.239 169.009 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 35.9 m -116.22 131.36 56.96 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.154 1.381 . . . . 0.0 110.38 177.51 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 50.3 t -117.96 143.26 46.52 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.457 1.903 . . . . 0.0 112.533 176.42 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 68.7 m -142.82 131.12 22.11 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.602 1.161 . . . . 0.0 111.417 177.158 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 . . . . . 0 N--CA 1.474 0.75 0 C-N-CA 126.641 1.977 . . . . 0.0 113.126 177.588 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 51.0 p90 . . . . . 0 CA--C 1.539 0.522 0 CA-C-O 120.606 0.241 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 46.0 t -107.87 136.07 44.46 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 124.887 1.275 . . . . 0.0 108.715 174.202 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -123.25 123.6 41.13 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.313 1.445 . . . . 0.0 108.776 -177.204 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 9.9 m-80 -123.48 152.51 41.63 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.559 1.543 . . . . 0.0 113.153 -167.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 12.6 t90 -117.51 135.71 53.74 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.836 1.654 . . . . 0.0 111.645 175.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -130.69 147.98 52.42 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.239 1.416 . . . . 0.0 113.481 -178.333 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 40.3 ttp180 -100.29 137.26 38.96 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 126.543 1.937 . . . . 0.0 107.331 167.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 16.0 ttm -112.02 134.84 53.33 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.321 1.448 . . . . 0.0 110.423 -175.362 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.1 m -91.4 157.5 42.24 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 124.82 1.248 . . . . 0.0 112.143 178.29 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -56.46 -31.48 85.99 Favored 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 124.209 3.273 . . . . 0.0 114.009 176.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.4 m -76.93 9.77 2.71 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.209 1.404 . . . . 0.0 113.624 177.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 64.2 t30 69.69 26.29 4.97 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 127.104 2.162 . . . . 0.0 112.908 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -94.45 168.36 10.92 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.245 1.018 . . . . 0.0 110.479 172.076 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.0 p -138.81 152.49 47.92 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.069 1.348 . . . . 0.0 111.536 -178.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -133.62 129.93 37.6 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 126.584 1.954 . . . . 0.0 110.105 -178.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -82.95 129.05 34.98 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.863 0.865 . . . . 0.0 111.389 -175.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 55.3 mt -104.21 -50.02 3.45 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.173 0.989 . . . . 0.0 111.963 -171.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -170.25 169.52 7.69 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.611 1.964 . . . . 0.0 109.675 -175.25 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.59 153.27 22.81 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.872 1.269 . . . . 0.0 110.926 -176.074 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -105.48 135.61 19.34 Favored Pre-proline 0 CA--C 1.547 0.846 0 C-N-CA 123.972 0.909 . . . . 0.0 110.994 174.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo . . . . . 0 C--N 1.352 0.727 0 CA-C-N 119.395 0.819 . . . . 0.0 111.102 -6.386 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.4 ptp180 . . . . . 0 N--CA 1.477 0.885 0 N-CA-C 114.71 1.374 . . . . 0.0 114.71 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -103.18 147.98 26.34 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.209 1.404 . . . . 0.0 111.968 -172.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -143.24 151.98 41.19 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.852 1.661 . . . . 0.0 111.989 172.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 46.2 t -121.32 128.56 75.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 124.414 1.085 . . . . 0.0 110.139 169.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 91.5 m -122.96 132.4 54.14 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.137 1.375 . . . . 0.0 110.312 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 24.8 tt0 -86.78 139.08 31.06 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.978 0.911 . . . . 0.0 110.722 173.26 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 28.7 mt -92.46 158.29 38.86 Favored Pre-proline 0 CA--C 1.546 0.794 0 C-N-CA 124.897 1.279 . . . . 0.0 111.808 177.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -67.72 -1.81 7.42 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 123.648 2.899 . . . . 0.0 114.235 175.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 25.3 m120 -64.81 -16.78 63.54 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 172.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 105.44 -34.0 6.11 Favored Glycine 0 N--CA 1.474 1.216 0 C-N-CA 126.127 1.822 . . . . 0.0 114.293 170.009 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 35.0 ptt180 -154.58 73.59 0.91 Allowed 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 123.098 1.428 . . . . 0.0 110.813 169.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -151.83 137.69 18.05 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 127.761 2.425 . . . . 0.0 106.958 179.32 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 -139.81 139.52 36.39 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -167.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -103.55 130.68 51.0 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.836 1.254 . . . . 0.0 111.71 170.51 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -107.04 105.4 15.4 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 127.276 2.23 . . . . 0.0 108.966 179.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 30.2 t -107.6 123.92 49.19 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.727 0.811 . . . . 0.0 112.705 -170.23 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 12.1 t -95.25 119.86 43.88 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 126.355 1.862 . . . . 0.0 106.928 169.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 81.3 t -91.43 128.54 43.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 123.558 0.743 . . . . 0.0 109.876 175.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 69.9 ttt180 53.46 60.55 3.63 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.911 1.684 . . . . 0.0 111.604 174.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.06 134.67 52.32 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.735 0.814 . . . . 0.0 111.362 -172.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.22 167.28 10.68 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.615 1.566 . . . . 0.0 110.261 -179.439 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 88.4 mtm-85 -56.88 -27.75 60.94 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 120.96 -1.088 . . . . 0.0 113.205 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -56.43 -27.77 57.58 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 126.673 1.989 . . . . 0.0 114.527 169.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 -86.95 -14.47 41.7 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 -175.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 52.7 m -59.36 129.88 44.19 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.793 1.179 . . . . 0.0 112.066 175.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 164.46 -159.7 32.67 Favored Glycine 0 N--CA 1.472 1.09 0 O-C-N 121.792 -0.567 . . . . 0.0 113.727 -176.2 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 8.5 m -100.65 144.42 29.65 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.107 1.363 . . . . 0.0 109.983 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 -143.62 155.43 44.26 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.653 1.581 . . . . 0.0 111.551 -178.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.3 pp -157.12 164.91 37.35 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.891 1.276 . . . . 0.0 112.525 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 21.2 t -113.78 155.51 25.52 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.282 1.433 . . . . 0.0 111.052 -179.382 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -154.67 144.23 10.89 Favored Glycine 0 N--CA 1.471 0.995 0 O-C-N 121.304 -0.873 . . . . 0.0 114.297 177.076 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -132.2 158.2 42.35 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -173.562 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 17.0 tt -152.34 134.97 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 125.316 1.446 . . . . 0.0 111.17 178.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 60.9 m -72.9 161.64 30.46 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.108 1.363 . . . . 0.0 113.417 177.324 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -59.73 -21.56 60.85 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 116.122 1.897 . . . . 0.0 116.122 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -72.92 147.73 88.84 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 124.399 1.08 . . . . 0.0 112.653 -173.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -67.22 -20.2 49.67 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.085 2.523 . . . . 0.0 112.75 176.469 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 82.7 tttt -75.82 -13.07 60.28 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 124.801 1.241 . . . . 0.0 113.558 174.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.11 161.64 26.45 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.533 1.133 . . . . 0.0 113.033 -177.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -147.98 152.76 38.04 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.914 1.686 . . . . 0.0 108.631 175.148 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 36.2 mt -71.69 115.39 11.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 O-C-N 121.695 -0.628 . . . . 0.0 110.63 -176.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 48.1 tttp -90.63 141.8 28.41 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.829 1.252 . . . . 0.0 109.661 169.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -110.87 151.01 28.35 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.69 1.196 . . . . 0.0 111.96 -175.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 59.8 p -86.4 176.95 7.6 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.815 1.246 . . . . 0.0 113.275 174.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 99.1 mt -68.65 139.95 55.47 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 166.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.63 148.97 33.02 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 -178.33 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -123.76 169.64 11.32 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 127.182 2.193 . . . . 0.0 111.243 177.266 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -119.74 141.7 49.2 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.981 1.312 . . . . 0.0 112.37 179.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 52.2 tp -109.69 137.8 46.98 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 125.817 1.647 . . . . 0.0 109.752 169.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -128.84 125.01 36.81 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.604 1.562 . . . . 0.0 110.31 173.078 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 40.6 t -108.13 112.44 40.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 C-N-CA 125.224 1.409 . . . . 0.0 108.597 169.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 64.6 p -91.59 154.93 18.72 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.573 1.549 . . . . 0.0 110.241 177.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -58.88 151.0 22.63 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.754 0.822 . . . . 0.0 112.693 -175.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 22.9 tpt180 . . . . . 0 N--CA 1.466 0.361 0 C-N-CA 124.895 1.278 . . . . 0.0 109.893 -176.549 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.0 t . . . . . 0 N--CA 1.471 0.585 0 CA-C-O 121.446 0.641 . . . . 0.0 111.568 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -134.34 125.66 28.08 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.964 1.706 . . . . 0.0 109.704 -173.073 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 91.0 p -140.87 157.49 67.34 Favored Pre-proline 0 CA--C 1.549 0.909 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 -169.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -68.32 162.17 80.04 Favored 'Cis proline' 0 C--N 1.355 0.92 0 CA-C-N 119.474 0.848 . . . . 0.0 111.862 -4.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.82 -26.52 68.17 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 176.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 48.0 tp -141.81 123.28 14.95 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.493 1.517 . . . . 0.0 108.889 170.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 53.7 tp -108.79 125.1 51.58 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.3 1.44 . . . . 0.0 109.34 172.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.2 t -110.4 121.39 63.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 124.165 0.986 . . . . 0.0 108.967 175.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.5 m -125.46 172.15 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 C-N-CA 125.009 1.323 . . . . 0.0 111.972 173.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 9.5 m -96.94 151.86 19.28 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 125.789 1.636 . . . . 0.0 110.612 176.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -45.71 122.81 3.9 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.536 1.134 . . . . 0.0 112.525 169.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.57 3.21 88.53 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 125.502 1.525 . . . . 0.0 114.508 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 31.2 t0 -90.4 159.12 16.75 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 119.393 1.597 . . . . 0.0 112.375 177.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 70.2 m-20 -88.96 117.57 28.07 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.345 1.058 . . . . 0.0 110.369 176.506 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -99.19 130.07 45.47 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.856 1.262 . . . . 0.0 110.547 178.22 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 60.9 m -131.92 127.2 35.93 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 119.347 0.976 . . . . 0.0 111.41 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -101.3 158.44 16.05 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.135 1.774 . . . . 0.0 110.474 172.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 37.5 m -106.69 131.23 54.06 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.322 1.449 . . . . 0.0 109.28 173.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 48.5 t -111.69 129.74 56.01 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.902 1.281 . . . . 0.0 110.893 169.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 8.4 t -122.46 131.22 53.76 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.537 1.135 . . . . 0.0 108.666 173.078 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 41.3 p90 . . . . . 0 N--CA 1.47 0.559 0 C-N-CA 124.442 1.097 . . . . 0.0 112.291 -176.188 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 28.5 p90 . . . . . 0 CA--C 1.537 0.472 0 N-CA-C 114.718 1.377 . . . . 0.0 114.718 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 64.5 t -105.88 129.48 58.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 126.529 1.932 . . . . 0.0 107.017 167.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 51.3 tp -99.32 143.21 29.84 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.94 1.296 . . . . 0.0 109.453 173.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -138.62 154.56 48.67 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.507 1.523 . . . . 0.0 111.032 -176.706 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 14.9 t90 -128.74 135.66 49.51 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.019 1.328 . . . . 0.0 110.744 175.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 57.8 m-85 -129.06 148.9 51.05 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.95 1.3 . . . . 0.0 113.596 -174.001 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 55.3 ttt-85 -109.03 142.99 38.92 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.694 1.598 . . . . 0.0 108.257 167.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 30.1 mtp -85.77 145.88 27.04 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 118.948 0.794 . . . . 0.0 112.509 176.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 69.1 m -94.07 157.66 37.42 Favored Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 125.494 1.518 . . . . 0.0 111.37 173.618 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -66.71 -16.72 51.2 Favored 'Trans proline' 0 CA--C 1.54 0.825 0 C-N-CA 123.256 2.637 . . . . 0.0 113.383 176.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 40.7 p -76.98 -1.15 27.26 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.118 1.767 . . . . 0.0 113.783 169.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 70.15 20.98 6.15 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 127.849 2.46 . . . . 0.0 113.08 -172.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -88.53 -172.68 3.85 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.423 1.089 . . . . 0.0 110.175 168.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.0 p -142.76 151.49 41.29 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.83 1.652 . . . . 0.0 110.728 -176.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -128.96 133.41 47.8 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 124.645 1.178 . . . . 0.0 111.616 174.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -78.15 129.22 34.9 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.43 1.092 . . . . 0.0 111.472 -179.158 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 57.9 mt -105.57 -47.75 3.84 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 125.575 1.55 . . . . 0.0 112.345 -169.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -162.04 170.02 19.99 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 127.072 2.149 . . . . 0.0 109.68 -174.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.55 171.52 19.5 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.41 1.084 . . . . 0.0 112.042 -172.291 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -146.79 111.45 4.17 Favored Pre-proline 0 CA--C 1.546 0.799 0 C-N-CA 125.026 1.33 . . . . 0.0 109.462 171.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo . . . . . 0 CA--C 1.54 0.794 0 CA-C-N 119.641 0.908 . . . . 0.0 111.721 -5.468 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 82.0 mtt85 . . . . . 0 N--CA 1.471 0.6 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -91.34 131.56 36.76 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 -164.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 21.4 ttm-85 -144.49 143.99 31.13 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.497 1.119 . . . . 0.0 112.352 169.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 91.8 t -107.3 131.31 57.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 126.638 1.975 . . . . 0.0 109.035 173.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 90.0 m -130.58 133.27 46.05 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.32 1.448 . . . . 0.0 110.686 -178.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -79.08 141.79 37.04 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.165 0.986 . . . . 0.0 112.318 178.095 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 26.6 mt -92.88 162.4 28.95 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 123.543 0.737 . . . . 0.0 111.628 171.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -58.04 -21.03 48.32 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 123.924 3.083 . . . . 0.0 114.093 172.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.409 HD22 ' HB2' ' A' ' 105' ' ' ASP . 41.1 t30 -64.99 -13.83 58.77 Favored 'General case' 0 CA--C 1.552 1.02 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 -179.325 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 83.08 -34.01 2.86 Favored Glycine 0 N--CA 1.475 1.281 0 C-N-CA 125.882 1.706 . . . . 0.0 114.649 171.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 23.0 ptt180 -130.17 73.5 1.54 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 125.391 1.476 . . . . 0.0 109.523 169.36 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . 0.409 ' HB2' HD22 ' A' ' 102' ' ' ASN . 0.3 OUTLIER -178.78 140.68 0.18 Allowed 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 127.569 2.348 . . . . 0.0 109.338 -177.364 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -147.3 153.64 39.97 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.316 1.046 . . . . 0.0 112.79 -168.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -106.91 139.51 41.21 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.609 1.564 . . . . 0.0 111.464 169.167 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.4 mpt? -120.1 106.11 11.66 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 126.471 1.908 . . . . 0.0 109.05 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 77.8 p -108.75 128.26 54.72 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.872 0.869 . . . . 0.0 113.333 -172.042 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 32.5 t -100.14 99.07 7.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 127.859 2.463 . . . . 0.0 106.846 169.107 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 29.2 m -74.46 139.77 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 O-C-N 121.749 -0.595 . . . . 0.0 111.861 178.456 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 32.2 ttm180 53.84 49.51 18.96 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.81 1.644 . . . . 0.0 112.626 170.265 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.5 148.56 50.4 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.195 0.998 . . . . 0.0 112.778 -171.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -124.32 164.73 19.0 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.836 1.254 . . . . 0.0 111.856 178.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 86.5 mtm-85 -52.58 -37.21 57.58 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.401 1.081 . . . . 0.0 113.557 -172.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -48.43 -34.31 10.77 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.859 2.064 . . . . 0.0 114.599 171.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -81.51 -13.91 57.57 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.504 1.122 . . . . 0.0 112.738 -168.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.8 m -59.92 131.1 49.82 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.307 1.043 . . . . 0.0 112.474 179.127 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 161.46 -166.83 36.08 Favored Glycine 0 N--CA 1.473 1.134 0 C-N-CA 124.418 1.008 . . . . 0.0 113.622 -171.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 7.6 m -96.62 140.0 31.88 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.28 1.032 . . . . 0.0 110.816 -175.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 64.8 m-85 -136.44 156.73 48.21 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.004 1.722 . . . . 0.0 111.704 179.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -156.59 150.89 25.34 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 176.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 52.1 t -95.04 151.62 19.03 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 126.486 1.914 . . . . 0.0 111.437 177.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -164.1 138.07 5.09 Favored Glycine 0 N--CA 1.472 1.069 0 O-C-N 121.424 -0.797 . . . . 0.0 114.538 172.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -121.27 159.2 26.48 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.474 1.11 . . . . 0.0 112.644 -178.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 21.2 tt -147.57 135.9 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 125.586 1.554 . . . . 0.0 111.249 -176.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 36.8 t -72.25 161.17 31.23 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.044 0.937 . . . . 0.0 113.46 -178.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 65.7 mt -82.83 -11.45 58.23 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.735 1.214 . . . . 0.0 112.693 169.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -68.73 157.23 89.17 Favored Pre-proline 0 CA--C 1.551 1.018 0 C-N-CA 125.067 1.347 . . . . 0.0 112.358 176.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -66.97 -21.82 49.18 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 122.968 2.445 . . . . 0.0 113.192 178.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.52 6.28 15.3 Favored 'General case' 0 CA--C 1.551 0.994 0 N-CA-C 114.817 1.414 . . . . 0.0 114.817 177.149 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -62.62 159.22 16.44 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.755 1.391 . . . . 0.0 114.755 -171.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -157.23 149.13 22.5 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 127.091 2.156 . . . . 0.0 108.29 -176.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 11.7 mm -71.44 107.6 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 171.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -82.31 88.42 6.54 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.954 0.902 . . . . 0.0 109.308 173.249 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -69.97 134.68 48.61 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.116 0.966 . . . . 0.0 111.37 -178.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 68.7 m -84.74 155.95 21.65 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.155 0.982 . . . . 0.0 112.338 171.457 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -59.82 128.26 36.02 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 121.694 -0.629 . . . . 0.0 109.426 169.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -69.67 157.99 36.21 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 114.371 1.249 . . . . 0.0 114.371 -170.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -127.77 164.41 22.21 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.791 2.037 . . . . 0.0 111.639 176.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -116.24 140.35 49.41 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.767 1.227 . . . . 0.0 111.542 177.354 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 62.1 tp -106.97 134.63 49.83 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.983 1.713 . . . . 0.0 109.563 169.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 59.7 ttt85 -126.92 122.67 35.25 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 125.652 1.581 . . . . 0.0 109.786 170.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 36.4 t -107.46 115.99 49.99 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 C-N-CA 124.866 1.266 . . . . 0.0 108.626 171.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 23.6 p -87.92 161.72 17.3 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.858 1.263 . . . . 0.0 110.925 -179.506 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -58.13 153.01 15.65 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 122.879 0.471 . . . . 0.0 110.376 168.295 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 17.2 mtt180 . . . . . 0 N--CA 1.467 0.386 0 C-N-CA 123.448 0.699 . . . . 0.0 110.011 176.688 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 15.2 t . . . . . 0 N--CA 1.47 0.555 0 N-CA-C 110.197 -0.298 . . . . 0.0 110.197 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -148.38 121.78 9.06 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.019 1.328 . . . . 0.0 111.075 -169.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 89.8 p -140.94 160.23 59.1 Favored Pre-proline 0 CA--C 1.55 0.981 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -172.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -68.49 162.55 79.94 Favored 'Cis proline' 0 C--N 1.354 0.825 0 CA-C-N 119.883 0.994 . . . . 0.0 111.482 -7.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.6 -30.74 71.57 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 174.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 33.1 tp -135.46 123.37 22.63 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.739 1.615 . . . . 0.0 109.061 171.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 57.6 tp -107.49 126.6 52.72 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.587 1.155 . . . . 0.0 109.358 169.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.4 t -110.2 124.32 66.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 124.011 0.924 . . . . 0.0 108.916 173.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.6 m -128.24 167.29 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 124.904 1.282 . . . . 0.0 111.938 173.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 51.4 m -93.62 148.92 21.66 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.571 1.148 . . . . 0.0 110.466 175.274 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -53.97 119.33 4.89 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.414 1.486 . . . . 0.0 112.103 178.227 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.04 -0.43 78.9 Favored Glycine 0 CA--C 1.532 1.124 0 C-N-CA 126.21 1.862 . . . . 0.0 115.057 -178.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 40.6 t0 -86.15 158.73 19.7 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 119.11 1.455 . . . . 0.0 111.223 171.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 12.1 p30 -80.85 150.84 28.96 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-O 121.911 0.862 . . . . 0.0 111.453 169.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -133.38 122.59 23.99 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.125 1.77 . . . . 0.0 110.576 -173.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 28.0 m -129.38 126.86 39.82 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 118.832 0.742 . . . . 0.0 111.854 -176.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -101.95 157.07 17.13 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.212 1.805 . . . . 0.0 109.817 169.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 31.6 m -106.35 123.78 48.58 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.944 1.298 . . . . 0.0 109.553 175.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 44.8 t -107.08 134.76 49.73 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.657 1.183 . . . . 0.0 109.735 168.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 9.2 m -133.72 128.82 35.72 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.7 0.8 . . . . 0.0 110.222 -174.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.1 p90 . . . . . 0 CA--C 1.537 0.476 0 C-N-CA 124.373 1.069 . . . . 0.0 111.595 173.767 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 32.9 p90 . . . . . 0 CA--C 1.538 0.507 0 N-CA-C 115.154 1.538 . . . . 0.0 115.154 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 58.2 t -124.33 135.29 64.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 127.49 2.316 . . . . 0.0 106.981 167.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 29.3 tp -99.39 138.7 36.11 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.509 0.724 . . . . 0.0 109.924 172.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.507 HD21 HG22 ' A' ' 126' ' ' ILE . 7.2 m-80 -130.93 159.19 38.17 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.818 1.247 . . . . 0.0 111.483 -172.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 9.0 t90 -125.84 138.21 53.8 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.312 1.045 . . . . 0.0 111.979 177.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -131.15 144.7 51.57 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.777 1.231 . . . . 0.0 112.796 -176.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -106.78 142.61 36.14 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.45 1.5 . . . . 0.0 108.54 168.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 26.1 mtp -83.29 143.91 30.07 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.95 0.795 . . . . 0.0 112.461 175.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 69.0 m -105.69 148.55 36.63 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 125.47 1.508 . . . . 0.0 111.081 176.028 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -68.05 -16.04 44.24 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 123.977 3.118 . . . . 0.0 114.024 -173.236 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 17.5 m -76.91 8.61 3.59 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.812 1.245 . . . . 0.0 113.206 171.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 57.6 t30 71.31 46.07 0.45 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 127.805 2.442 . . . . 0.0 111.466 -177.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -131.38 -172.66 2.9 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.669 1.588 . . . . 0.0 110.27 -178.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.7 p -144.47 149.18 35.56 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.964 1.706 . . . . 0.0 110.526 -176.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -125.28 134.65 52.2 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.106 1.362 . . . . 0.0 111.314 176.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -78.84 133.0 37.04 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.988 0.915 . . . . 0.0 111.517 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 53.5 mt -107.65 -46.77 3.75 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.767 1.227 . . . . 0.0 112.714 -169.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -169.79 169.42 8.42 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.73 2.012 . . . . 0.0 110.482 -172.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -157.25 162.01 39.22 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.861 1.265 . . . . 0.0 113.163 -179.226 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -139.92 122.5 10.12 Favored Pre-proline 0 CA--C 1.547 0.839 0 C-N-CA 126.326 1.851 . . . . 0.0 110.1 174.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_exo . . . . . 0 C--N 1.351 0.661 0 CA-C-N 120.56 1.236 . . . . 0.0 113.719 -7.659 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 41.3 mtm180 . . . . . 0 CA--C 1.533 0.301 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -67.22 142.11 57.06 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.548 1.539 . . . . 0.0 110.968 168.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 85.0 mtm180 -143.85 148.75 35.94 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.997 1.719 . . . . 0.0 111.281 -174.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . 0.435 HG22 ' SD ' ' A' ' 108' ' ' MET . 40.2 t -126.49 126.33 68.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 125.451 1.5 . . . . 0.0 108.452 171.591 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 87.9 m -130.61 130.52 44.1 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.075 0.95 . . . . 0.0 110.996 178.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 65.4 tt0 -82.85 135.08 35.05 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 118.658 0.663 . . . . 0.0 110.042 169.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 37.1 mt -91.85 158.94 39.13 Favored Pre-proline 0 CA--C 1.543 0.681 0 C-N-CA 124.112 0.965 . . . . 0.0 112.205 -172.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -63.92 -6.88 11.9 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 123.64 2.893 . . . . 0.0 114.02 174.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -63.32 -26.15 68.63 Favored 'General case' 0 CA--C 1.55 0.974 0 CA-C-N 119.462 1.028 . . . . 0.0 112.155 168.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 91.19 -34.08 4.44 Favored Glycine 0 CA--C 1.531 1.037 0 C-N-CA 126.717 2.103 . . . . 0.0 113.938 175.155 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -126.84 73.44 1.41 Allowed 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.917 1.287 . . . . 0.0 109.48 171.376 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -178.37 146.0 0.36 Allowed 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 126.396 1.878 . . . . 0.0 110.742 -177.416 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -145.83 139.8 26.62 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.031 0.933 . . . . 0.0 111.773 -170.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -98.91 131.03 45.3 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.403 1.081 . . . . 0.0 111.85 169.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.435 ' SD ' HG22 ' A' ' 97' ' ' VAL . 20.8 mmt -108.98 103.24 12.23 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.983 2.113 . . . . 0.0 107.726 174.516 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 22.8 t -121.46 125.55 47.16 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 114.9 1.444 . . . . 0.0 114.9 -167.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 3.7 t -92.35 123.24 44.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 125.244 1.417 . . . . 0.0 108.229 168.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 87.6 t -82.89 128.4 38.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 168.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 44.3 ttt85 56.78 69.67 0.72 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.787 1.235 . . . . 0.0 112.07 171.03 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -74.35 134.48 42.5 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.409 1.083 . . . . 0.0 111.508 -177.324 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -108.63 163.03 13.6 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.032 1.733 . . . . 0.0 109.666 174.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 64.6 mtp85 -56.83 -28.01 60.94 Favored 'General case' 0 N--CA 1.478 0.947 0 O-C-N 121.021 -1.049 . . . . 0.0 113.74 179.116 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -61.46 -16.72 49.79 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.306 1.443 . . . . 0.0 114.623 171.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -89.68 -12.84 38.35 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.218 1.407 . . . . 0.0 113.634 178.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 48.1 m -64.74 138.16 58.22 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 120.815 -1.178 . . . . 0.0 112.132 -178.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 149.2 -165.8 29.43 Favored Glycine 0 N--CA 1.474 1.192 0 C-N-CA 124.13 0.871 . . . . 0.0 113.592 -176.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.5 m -91.23 142.66 27.48 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.165 1.386 . . . . 0.0 111.284 -174.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -138.78 160.82 38.76 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.678 1.991 . . . . 0.0 111.745 -178.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -156.29 147.12 21.96 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.603 1.161 . . . . 0.0 113.355 173.517 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 51.4 t -84.16 150.44 25.51 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.341 1.857 . . . . 0.0 110.704 173.156 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -161.43 129.52 2.13 Favored Glycine 0 N--CA 1.474 1.172 0 O-C-N 121.184 -0.947 . . . . 0.0 114.4 174.209 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -90.66 159.26 16.49 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.151 0.981 . . . . 0.0 112.197 178.638 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.507 HG22 HD21 ' A' ' 66' ' ' ASN . 17.2 tt -146.39 138.67 19.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 124.702 1.201 . . . . 0.0 109.781 170.515 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 7.3 m -81.11 161.48 24.1 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.763 0.825 . . . . 0.0 112.384 179.609 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 55.9 mt -78.6 -12.51 60.02 Favored 'General case' 0 N--CA 1.476 0.875 0 N-CA-C 114.115 1.154 . . . . 0.0 114.115 178.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -67.03 148.19 98.93 Favored Pre-proline 0 CA--C 1.553 1.064 0 C-N-CA 124.12 0.968 . . . . 0.0 112.532 179.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -55.96 -28.79 70.46 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 123.598 2.865 . . . . 0.0 114.601 176.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -85.14 4.42 34.45 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.747 1.219 . . . . 0.0 114.227 -179.063 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -63.09 159.17 17.88 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.99 1.108 . . . . 0.0 113.99 -176.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -150.63 166.54 30.02 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.73 2.012 . . . . 0.0 109.005 174.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 51.0 mt -73.11 114.16 12.05 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-O 121.584 0.707 . . . . 0.0 109.918 -178.155 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -81.47 88.37 6.16 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.991 1.716 . . . . 0.0 107.917 169.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -75.4 141.73 43.18 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.136 0.975 . . . . 0.0 112.354 -171.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 6.9 t -91.35 178.64 5.91 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.803 1.241 . . . . 0.0 111.848 169.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.6 pp -76.35 159.05 30.88 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.868 0.867 . . . . 0.0 112.061 174.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 91.0 mtm180 -83.58 150.54 25.87 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.251 1.02 . . . . 0.0 113.038 -174.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -136.93 169.62 17.47 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 127.164 2.186 . . . . 0.0 109.693 169.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -132.57 147.57 52.35 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 177.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 63.6 tp -107.41 134.46 50.42 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 126.982 2.113 . . . . 0.0 109.954 177.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 69.5 ttt180 -122.62 121.55 36.7 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 125.938 1.695 . . . . 0.0 109.885 171.393 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 44.2 t -103.39 117.6 49.09 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.704 1.202 . . . . 0.0 108.848 170.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 74.4 p -96.54 150.97 20.03 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.578 1.551 . . . . 0.0 110.24 177.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -64.03 142.74 58.3 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.328 0.585 . . . . 0.0 111.851 -178.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 54.1 ttp180 . . . . . 0 CA--C 1.535 0.372 0 C-N-CA 123.782 0.833 . . . . 0.0 110.147 179.291 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 66.6 p . . . . . 0 N--CA 1.471 0.615 0 CA-C-O 121.891 0.853 . . . . 0.0 112.043 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -144.14 124.66 13.98 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.043 1.737 . . . . 0.0 108.869 178.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 78.9 p -140.82 161.15 55.67 Favored Pre-proline 0 CA--C 1.55 0.95 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 -168.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -66.43 163.54 69.51 Favored 'Cis proline' 0 C--N 1.355 0.881 0 CA-C-N 119.572 0.883 . . . . 0.0 111.664 -7.509 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.78 -33.12 71.28 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 174.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.6 tt -136.34 124.32 22.82 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.61 1.564 . . . . 0.0 109.139 171.02 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.4 tp -106.75 130.3 54.49 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.75 1.22 . . . . 0.0 108.948 169.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 12.8 p -113.0 129.92 67.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 C-N-CA 124.007 0.923 . . . . 0.0 109.692 169.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.6 m -131.81 164.76 33.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 125.065 1.346 . . . . 0.0 111.348 174.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 16.8 m -89.87 149.02 22.83 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.553 1.141 . . . . 0.0 110.303 172.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -53.88 121.7 8.5 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.047 1.339 . . . . 0.0 111.015 175.657 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.24 4.12 78.01 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 125.486 1.517 . . . . 0.0 114.894 -176.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -95.71 150.21 20.63 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 119.577 1.688 . . . . 0.0 111.159 169.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -75.41 130.77 39.5 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.267 -0.896 . . . . 0.0 111.543 175.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -101.71 122.08 43.25 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 125.47 1.508 . . . . 0.0 110.174 175.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 60.5 m -128.16 124.35 36.62 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.023 0.929 . . . . 0.0 110.827 -178.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -102.45 159.54 15.34 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 127.21 2.204 . . . . 0.0 110.524 175.265 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 30.7 m -113.21 127.55 56.21 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.956 1.302 . . . . 0.0 110.006 177.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 53.1 t -111.66 142.02 44.51 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.785 1.634 . . . . 0.0 111.854 173.33 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.5 t -138.89 119.32 13.8 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.717 0.807 . . . . 0.0 111.309 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 . . . . . 0 N--CA 1.472 0.646 0 C-N-CA 126.235 1.814 . . . . 0.0 113.103 -179.939 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 55.2 p90 . . . . . 0 CA--C 1.54 0.565 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 90.7 t -95.97 134.77 32.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 125.672 1.589 . . . . 0.0 107.467 169.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.4 tp -99.33 145.84 26.9 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.705 1.202 . . . . 0.0 109.472 170.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -134.92 156.76 48.41 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.844 1.657 . . . . 0.0 111.984 -169.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 22.6 t90 -136.24 138.84 42.24 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.553 1.141 . . . . 0.0 112.103 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 48.6 m-85 -138.9 149.09 44.43 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.818 1.247 . . . . 0.0 114.009 -172.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -109.13 143.36 38.61 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.779 1.631 . . . . 0.0 108.531 167.566 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 31.7 mtp -84.58 143.92 28.98 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 119.437 1.017 . . . . 0.0 112.612 173.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 45.6 m -91.48 158.02 41.31 Favored Pre-proline 0 CA--C 1.548 0.901 0 C-N-CA 124.954 1.302 . . . . 0.0 111.601 173.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_exo -55.5 -32.39 82.3 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 123.983 3.122 . . . . 0.0 114.495 178.373 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.0 m -76.94 5.93 7.11 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 124.892 1.277 . . . . 0.0 113.845 177.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 73.99 20.94 2.71 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 127.828 2.451 . . . . 0.0 113.041 -176.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -89.4 -172.61 3.68 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.585 1.154 . . . . 0.0 110.287 169.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.1 p -144.06 146.96 33.18 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 125.597 1.559 . . . . 0.0 110.521 -176.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -121.96 132.42 54.53 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 125.077 1.351 . . . . 0.0 110.848 175.317 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 33.3 tttm -80.57 117.18 21.05 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.194 1.398 . . . . 0.0 110.9 -177.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 71.7 mt -90.07 -52.72 4.81 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 125.187 1.395 . . . . 0.0 111.253 -172.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -160.74 173.51 15.3 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.84 1.256 . . . . 0.0 111.79 -178.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -156.06 156.4 34.31 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.437 1.495 . . . . 0.0 111.798 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -142.0 129.46 11.5 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 125.004 1.322 . . . . 0.0 110.73 178.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo . . . . . 0 C--N 1.353 0.766 0 CA-C-N 120.498 1.214 . . . . 0.0 112.825 -8.315 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 48.1 mtp180 . . . . . 0 N--CA 1.467 0.422 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -97.7 119.71 36.77 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.221 1.409 . . . . 0.0 110.398 -174.07 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -139.48 145.67 39.06 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.416 1.086 . . . . 0.0 112.044 -169.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -126.56 135.95 62.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 125.153 1.381 . . . . 0.0 112.052 170.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 91.8 m -130.5 130.17 43.84 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.446 1.498 . . . . 0.0 110.756 -177.081 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -79.37 134.32 36.58 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.318 1.047 . . . . 0.0 110.371 173.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 36.4 mt -88.27 159.65 47.18 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 123.657 0.783 . . . . 0.0 111.829 178.199 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -63.4 -7.46 12.38 Favored 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 123.563 2.842 . . . . 0.0 113.979 173.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -67.23 -14.5 62.97 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 119.174 0.897 . . . . 0.0 112.946 169.157 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 83.98 -34.08 3.04 Favored Glycine 0 N--CA 1.473 1.123 0 C-N-CA 126.92 2.2 . . . . 0.0 114.343 172.092 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.67 73.59 1.46 Allowed 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 123.733 1.73 . . . . 0.0 109.669 173.349 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -174.89 141.72 0.62 Allowed 'General case' 0 C--O 1.237 0.418 0 C-N-CA 128.51 2.724 . . . . 0.0 108.095 -176.413 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -145.04 149.92 35.96 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.853 1.057 . . . . 0.0 113.853 -167.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -104.06 132.77 49.97 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.805 1.242 . . . . 0.0 110.479 167.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -112.87 123.31 50.02 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 126.652 1.981 . . . . 0.0 108.211 174.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 9.4 t -130.44 133.75 46.58 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 114.257 1.206 . . . . 0.0 114.257 -169.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 61.7 t -105.35 101.92 13.07 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 126.651 1.98 . . . . 0.0 106.817 168.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 98.0 t -73.2 125.53 32.3 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 123.66 0.784 . . . . 0.0 110.649 -177.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 72.3 mtt-85 51.08 70.42 0.53 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.597 1.959 . . . . 0.0 112.034 -177.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -66.34 134.09 51.86 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.79 1.636 . . . . 0.0 111.476 -178.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 8.3 mpt_? -108.38 166.68 10.58 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 126.11 1.764 . . . . 0.0 109.289 172.597 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 35.2 mtp180 -57.22 -30.2 64.39 Favored 'General case' 0 N--CA 1.478 0.962 0 O-C-N 121.033 -1.042 . . . . 0.0 113.619 -174.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -61.68 -19.39 62.29 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.464 1.506 . . . . 0.0 114.756 173.222 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 37.4 m-20 -84.59 -12.83 53.28 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 119.966 1.257 . . . . 0.0 113.481 177.223 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 48.4 m -63.1 143.85 57.42 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.734 1.152 . . . . 0.0 112.597 -179.466 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 143.42 -166.83 26.72 Favored Glycine 0 N--CA 1.474 1.173 0 O-C-N 121.262 -0.898 . . . . 0.0 113.469 -176.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.9 m -91.71 143.59 26.39 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 125.173 1.389 . . . . 0.0 111.08 -172.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -142.19 161.2 38.6 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.09 1.756 . . . . 0.0 111.57 -177.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -161.68 165.12 28.66 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.926 1.29 . . . . 0.0 113.054 177.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 13.6 t -108.79 156.65 19.38 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.974 1.709 . . . . 0.0 111.038 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -144.66 174.6 24.76 Favored Glycine 0 N--CA 1.47 0.959 0 C-N-CA 124.791 1.186 . . . . 0.0 113.436 176.274 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -152.45 159.24 43.39 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.184 0.994 . . . . 0.0 112.934 175.114 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 18.1 tt -152.22 135.01 6.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 125.463 1.505 . . . . 0.0 110.286 174.511 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 58.1 p -72.48 161.51 30.7 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.249 -0.907 . . . . 0.0 113.146 178.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 48.2 mt -75.58 -2.15 27.81 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 -179.029 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -68.07 150.83 97.6 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 124.611 1.164 . . . . 0.0 112.521 177.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_endo -69.51 -23.59 31.75 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.016 2.477 . . . . 0.0 112.787 176.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -91.38 8.1 37.83 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 125.088 1.355 . . . . 0.0 113.717 178.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.14 161.71 18.52 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.743 1.217 . . . . 0.0 113.922 -175.124 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -149.48 151.83 34.6 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.783 1.633 . . . . 0.0 109.251 178.233 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 51.2 mt -76.1 127.78 37.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 123.594 0.758 . . . . 0.0 111.957 -173.174 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -99.35 151.03 21.53 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.126 1.77 . . . . 0.0 109.328 168.097 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -132.54 149.12 52.37 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.27 1.028 . . . . 0.0 111.969 -172.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 60.6 p -87.6 177.85 6.94 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.858 1.263 . . . . 0.0 113.725 175.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -68.38 152.25 45.7 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.636 0.774 . . . . 0.0 109.208 166.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -82.12 152.84 26.36 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.113 0.965 . . . . 0.0 113.332 -177.405 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -124.67 169.66 11.75 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 127.158 2.183 . . . . 0.0 109.932 169.038 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -135.97 151.51 50.01 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 170.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 60.4 tp -112.87 132.91 55.1 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 126.704 2.002 . . . . 0.0 110.543 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 69.9 ttt180 -118.06 118.06 30.89 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.477 1.911 . . . . 0.0 109.663 171.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 42.4 t -102.3 116.67 46.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 123.82 0.848 . . . . 0.0 109.012 169.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 73.7 p -95.96 154.2 17.36 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.967 1.707 . . . . 0.0 110.606 178.251 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -64.61 145.61 55.91 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.641 -0.662 . . . . 0.0 112.32 -178.06 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 38.9 ttt85 . . . . . 0 N--CA 1.469 0.489 0 C-N-CA 124.476 1.111 . . . . 0.0 110.361 179.909 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.8 t . . . . . 0 N--CA 1.475 0.812 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.55 ' CE1' ' HB3' ' A' ' 123' ' ' CYS . 1.0 OUTLIER -125.99 136.52 53.08 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 125.522 1.529 . . . . 0.0 109.674 178.164 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 88.9 p -141.02 156.2 68.44 Favored Pre-proline 0 N--CA 1.478 0.935 0 N-CA-C 114.793 1.405 . . . . 0.0 114.793 -178.732 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -69.52 161.55 85.24 Favored 'Cis proline' 0 C--N 1.352 0.747 0 CA-C-N 119.307 0.788 . . . . 0.0 111.194 -10.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.47 -34.09 73.52 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 172.418 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 31.9 tp -132.83 121.14 22.51 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.757 1.623 . . . . 0.0 109.04 171.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 51.5 tp -105.09 130.38 53.29 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.63 1.172 . . . . 0.0 109.475 170.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.1 t -112.92 124.97 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 123.864 0.865 . . . . 0.0 109.104 173.087 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.3 m -127.22 166.36 24.1 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 C-N-CA 125.03 1.332 . . . . 0.0 111.828 173.417 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 45.4 m -91.47 147.16 23.22 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.337 1.055 . . . . 0.0 110.211 173.384 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 65.1 tt0 -53.96 116.44 2.56 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.79 1.636 . . . . 0.0 112.245 177.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 94.23 3.61 63.28 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 126.365 1.936 . . . . 0.0 114.825 -177.25 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 37.2 t0 -91.2 159.51 16.02 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 119.581 1.69 . . . . 0.0 111.622 172.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -85.32 130.58 34.56 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.224 -0.923 . . . . 0.0 111.373 172.263 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -103.01 133.83 47.47 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.923 1.689 . . . . 0.0 110.745 178.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 27.8 m -132.74 127.98 35.88 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.446 1.099 . . . . 0.0 111.906 178.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -105.36 159.56 15.81 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.222 2.209 . . . . 0.0 110.465 169.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 29.7 m -101.13 140.58 35.23 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.606 1.563 . . . . 0.0 109.182 169.56 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 17.4 t -131.53 131.94 43.78 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.697 1.599 . . . . 0.0 111.594 171.586 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 9.9 m -122.97 132.71 54.27 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.38 1.072 . . . . 0.0 111.109 179.271 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 . . . . . 0 N--CA 1.47 0.552 0 C-N-CA 126.168 1.787 . . . . 0.0 113.157 169.455 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 38.1 p90 . . . . . 0 CA--C 1.541 0.621 0 CA-C-O 120.905 0.383 . . . . 0.0 111.809 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 30.4 t -95.97 138.27 21.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 125.387 1.475 . . . . 0.0 107.594 170.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 9.0 tt -127.78 131.26 49.64 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.373 1.469 . . . . 0.0 109.583 -177.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -145.66 160.91 41.0 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 115.323 1.601 . . . . 0.0 115.323 -167.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 61.1 t-105 -113.94 148.84 36.16 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 126.585 1.954 . . . . 0.0 112.253 -179.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -141.14 146.63 37.27 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.528 1.531 . . . . 0.0 113.89 -172.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 34.3 ttp-105 -91.21 140.21 30.01 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.887 1.675 . . . . 0.0 108.152 167.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 21.1 mtp -86.6 136.75 32.93 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 119.328 0.967 . . . . 0.0 111.021 168.274 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 68.8 m -106.32 148.67 37.11 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 125.143 1.377 . . . . 0.0 110.986 177.187 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -68.45 -17.6 43.81 Favored 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 124.085 3.19 . . . . 0.0 113.711 -171.065 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.4 m -76.97 21.31 0.22 Allowed 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 125.278 1.431 . . . . 0.0 112.927 170.765 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 64.5 t30 64.35 39.99 6.79 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.685 2.394 . . . . 0.0 112.455 177.447 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -133.05 179.24 6.3 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.139 1.376 . . . . 0.0 111.001 -172.573 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.8 p -137.03 152.51 50.19 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 125.528 1.531 . . . . 0.0 111.043 -177.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -133.33 131.56 40.27 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.747 1.219 . . . . 0.0 110.88 178.373 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 5.4 ttpm? -78.91 132.43 36.75 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.553 0.741 . . . . 0.0 111.876 -173.355 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 83.9 mt -110.49 -46.82 3.35 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 125.038 1.335 . . . . 0.0 112.205 -171.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -152.84 160.02 43.07 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.39 1.076 . . . . 0.0 111.573 -179.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -154.07 149.05 26.74 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.513 1.125 . . . . 0.0 112.977 -172.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -136.02 126.8 16.79 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 125.916 1.686 . . . . 0.0 109.908 169.456 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo . . . . . 0 C--N 1.351 0.709 0 CA-C-N 120.275 1.134 . . . . 0.0 113.278 -10.733 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 47.8 mtp180 . . . . . 0 N--CA 1.469 0.507 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -95.98 133.63 39.97 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.222 1.009 . . . . 0.0 111.083 -176.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 66.2 mtm180 -143.33 152.24 41.41 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.174 0.99 . . . . 0.0 113.105 -171.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.8 t -121.61 130.61 74.45 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 126.483 1.913 . . . . 0.0 108.562 169.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 94.6 m -129.44 135.41 48.63 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 125.17 1.388 . . . . 0.0 110.444 -175.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -76.31 141.75 41.5 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.217 1.007 . . . . 0.0 111.519 178.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 96.4 mt -101.48 157.05 34.4 Favored Pre-proline 0 CA--C 1.542 0.661 0 C-N-CA 124.16 0.984 . . . . 0.0 111.582 170.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -70.39 -2.8 11.21 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 123.537 2.825 . . . . 0.0 113.527 173.573 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -72.46 -6.0 40.63 Favored 'General case' 0 CA--C 1.551 1.019 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -179.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 95.55 -31.92 6.72 Favored Glycine 0 CA--C 1.534 1.266 0 C-N-CA 126.019 1.771 . . . . 0.0 115.27 169.47 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 32.6 ptt180 -154.6 73.76 0.91 Allowed 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.546 1.538 . . . . 0.0 109.905 172.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -167.36 145.47 4.77 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 126.287 1.835 . . . . 0.0 108.925 -169.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -144.42 150.11 37.15 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -168.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -101.1 138.0 38.71 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.239 1.416 . . . . 0.0 110.111 167.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 6.9 mmt -123.51 117.84 26.02 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 126.545 1.938 . . . . 0.0 108.3 -176.002 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 71.0 p -131.27 148.7 52.72 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 115.602 1.704 . . . . 0.0 115.602 -169.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 22.1 t -118.66 102.76 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 C-N-CA 127.478 2.311 . . . . 0.0 107.233 176.55 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 58.6 t -78.02 131.86 33.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 124.006 0.923 . . . . 0.0 110.147 -178.015 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 3.7 tpt180 63.07 53.93 2.22 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.423 1.489 . . . . 0.0 111.198 175.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.43 123.61 22.75 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.573 1.149 . . . . 0.0 111.062 -174.392 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? -106.73 169.76 8.34 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 126.085 1.754 . . . . 0.0 110.295 177.61 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 22.2 mmm180 -49.19 -37.35 22.33 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.61 1.164 . . . . 0.0 113.84 -175.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -60.07 -25.09 65.1 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 125.271 1.429 . . . . 0.0 114.697 175.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 -81.8 -1.87 48.88 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.896 1.278 . . . . 0.0 113.272 178.44 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 33.1 m -70.32 124.04 23.18 Favored 'General case' 0 CA--C 1.543 0.699 0 O-C-N 120.18 -1.575 . . . . 0.0 111.238 173.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 165.96 -171.48 41.08 Favored Glycine 0 N--CA 1.474 1.173 0 O-C-N 121.682 -0.636 . . . . 0.0 114.306 -177.068 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.0 m -88.9 139.72 30.17 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.725 1.21 . . . . 0.0 110.714 -179.254 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -144.2 157.67 44.16 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.046 1.738 . . . . 0.0 111.007 -177.376 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.5 pp -155.16 165.36 36.93 Favored 'General case' 0 N--CA 1.469 0.478 0 O-C-N 121.25 -0.906 . . . . 0.0 113.243 -178.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . 0.55 ' HB3' ' CE1' ' A' ' 37' ' ' PHE . 48.4 t -111.16 156.12 21.88 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.243 1.417 . . . . 0.0 110.574 175.064 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -144.51 167.95 26.89 Favored Glycine 0 CA--C 1.524 0.653 0 C-N-CA 124.496 1.046 . . . . 0.0 112.536 171.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -145.13 149.34 34.83 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.869 0.868 . . . . 0.0 111.844 175.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.4 tt -148.9 133.08 8.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 125.452 1.501 . . . . 0.0 110.842 -176.091 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 14.5 m -66.39 159.58 26.61 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.397 1.079 . . . . 0.0 112.656 179.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 29.4 mt -73.28 -14.38 61.3 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.213 1.19 . . . . 0.0 114.213 -174.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -72.35 143.03 85.09 Favored Pre-proline 0 CA--C 1.552 1.054 0 C-N-CA 124.294 1.037 . . . . 0.0 112.329 177.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -56.22 -27.01 64.07 Favored 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 123.829 3.019 . . . . 0.0 115.153 177.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -78.81 -4.34 48.96 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 -178.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.97 169.49 13.18 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 124.891 1.276 . . . . 0.0 113.766 -176.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -149.76 162.48 40.18 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.157 1.783 . . . . 0.0 110.21 175.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 10.0 mm -73.08 123.44 27.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-O 121.756 0.789 . . . . 0.0 111.757 -178.217 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -84.67 143.29 29.31 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 126.799 2.04 . . . . 0.0 110.171 169.636 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -134.14 158.85 42.6 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.594 1.558 . . . . 0.0 112.188 -172.12 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 5.9 t -140.21 -163.88 1.6 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.784 1.234 . . . . 0.0 111.664 169.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -65.89 114.34 5.04 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.545 1.538 . . . . 0.0 110.424 -178.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 1.4 ptp180 -71.43 154.74 41.31 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 125.372 1.469 . . . . 0.0 112.939 -177.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.89 169.63 9.09 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.633 1.973 . . . . 0.0 111.225 -171.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -136.51 146.84 46.69 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 122.228 1.013 . . . . 0.0 112.956 175.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 58.4 tp -109.69 134.29 52.14 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 127.1 2.16 . . . . 0.0 109.531 179.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 70.6 ttt180 -121.12 123.91 43.46 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 125.937 1.695 . . . . 0.0 109.574 171.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 53.9 t -103.07 120.44 52.93 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 C-N-CA 124.497 1.119 . . . . 0.0 108.132 169.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 54.7 p -93.29 147.53 22.83 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.289 1.436 . . . . 0.0 109.411 174.099 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -59.86 148.07 36.1 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.444 0.698 . . . . 0.0 112.244 -174.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 60.1 ttp180 . . . . . 0 C--O 1.238 0.45 0 C-N-CA 125.016 1.326 . . . . 0.0 110.199 -170.947 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.2 t . . . . . 0 N--CA 1.476 0.858 0 CA-C-O 120.52 0.2 . . . . 0.0 111.395 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -122.52 135.36 54.63 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.166 1.386 . . . . 0.0 110.776 -172.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 94.2 p -141.01 157.14 67.84 Favored Pre-proline 0 CA--C 1.55 0.98 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -179.007 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -69.84 162.58 84.05 Favored 'Cis proline' 0 C--N 1.353 0.809 0 CA-C-N 118.919 0.65 . . . . 0.0 111.279 -9.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.33 -34.1 71.94 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 171.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 53.2 tp -140.16 122.91 16.4 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.433 1.493 . . . . 0.0 109.41 172.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.9 tp -105.16 127.23 52.81 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.76 1.624 . . . . 0.0 109.186 171.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.8 t -111.05 124.5 67.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 123.912 0.885 . . . . 0.0 108.879 172.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.1 m -129.38 168.14 23.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 C-N-CA 124.935 1.294 . . . . 0.0 111.567 172.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 23.4 m -92.33 151.67 20.17 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.165 1.386 . . . . 0.0 110.44 173.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -52.13 123.89 11.68 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.436 1.094 . . . . 0.0 110.7 169.026 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 89.5 -2.92 83.43 Favored Glycine 0 CA--C 1.533 1.16 0 C-N-CA 125.616 1.579 . . . . 0.0 114.762 -177.614 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -91.31 158.39 16.58 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 119.393 1.597 . . . . 0.0 112.012 175.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -87.65 123.59 32.65 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.171 0.988 . . . . 0.0 110.901 178.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -101.59 129.96 47.81 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.955 1.302 . . . . 0.0 110.534 177.072 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 27.1 m -131.7 128.02 38.09 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.407 1.083 . . . . 0.0 111.021 177.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -102.8 154.5 19.12 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 126.628 1.971 . . . . 0.0 110.505 169.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 65.4 m -107.37 134.15 50.85 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.172 1.389 . . . . 0.0 109.001 170.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 73.2 m -130.05 114.73 16.14 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.653 1.181 . . . . 0.0 110.337 175.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 22.6 t -97.4 154.65 17.33 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 125.142 1.377 . . . . 0.0 110.237 179.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 53.8 m-85 . . . . . 0 CA--C 1.536 0.412 0 C-N-CA 124.742 1.217 . . . . 0.0 113.979 -169.944 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 38.5 p90 . . . . . 0 CA--C 1.539 0.535 0 CA-C-O 121.128 0.49 . . . . 0.0 112.031 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.7 t -95.95 133.08 38.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 125.513 1.525 . . . . 0.0 108.178 169.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.32 129.46 45.53 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.445 1.098 . . . . 0.0 108.694 169.264 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 35.2 m120 -125.52 147.75 49.14 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.108 1.363 . . . . 0.0 111.133 179.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 18.9 t90 -122.02 139.39 53.75 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.482 1.113 . . . . 0.0 111.473 176.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -135.44 144.84 46.68 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.496 1.118 . . . . 0.0 113.859 -170.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.4 ttt-85 -106.54 134.97 48.86 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.516 1.126 . . . . 0.0 108.85 167.556 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.95 130.36 34.49 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.679 1.592 . . . . 0.0 110.614 170.643 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 19.0 m -104.31 158.79 31.2 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 126.014 1.725 . . . . 0.0 111.727 179.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -67.71 -17.42 47.65 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 123.986 3.124 . . . . 0.0 113.98 -174.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 70.6 m -80.08 21.94 0.55 Allowed 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 124.33 1.052 . . . . 0.0 112.28 168.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . 0.274 0.9 OUTLIER 54.31 33.85 19.28 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 128.147 2.579 . . . . 0.0 114.561 179.265 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -118.01 158.9 24.12 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.793 1.237 . . . . 0.0 111.397 178.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.3 p -113.0 144.35 42.74 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 125.815 1.646 . . . . 0.0 109.79 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -129.04 130.69 46.91 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 123.636 0.774 . . . . 0.0 111.313 177.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 32.0 ttmt -74.24 121.15 20.82 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.688 1.195 . . . . 0.0 110.355 -178.065 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 80.2 mt -94.48 -47.57 6.5 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 125.51 1.524 . . . . 0.0 111.911 -170.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -167.84 170.5 10.67 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 127.287 2.235 . . . . 0.0 109.18 -177.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.65 161.78 35.04 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.181 0.992 . . . . 0.0 112.451 -171.124 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -144.18 118.5 5.92 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.872 1.269 . . . . 0.0 111.131 169.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo . . . . . 0 C--N 1.352 0.715 0 CA-C-N 120.027 1.045 . . . . 0.0 112.166 -11.571 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 12.2 ptp180 . . . . . 0 N--CA 1.472 0.671 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -93.77 137.42 33.03 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.49 1.116 . . . . 0.0 112.171 -173.173 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 72.1 mtm180 -140.72 151.51 44.56 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.804 1.241 . . . . 0.0 112.607 -179.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 59.0 t -126.51 126.65 69.37 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 126.078 1.751 . . . . 0.0 109.002 169.035 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 99.5 m -118.53 132.55 56.21 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.736 1.614 . . . . 0.0 109.78 176.588 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.17 141.74 28.32 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.617 1.167 . . . . 0.0 111.949 176.572 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 32.1 mt -97.77 157.98 33.74 Favored Pre-proline 0 CA--C 1.544 0.723 0 C-N-CA 123.749 0.82 . . . . 0.0 111.149 175.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -65.66 -5.02 10.81 Favored 'Trans proline' 0 CA--C 1.541 0.858 0 C-N-CA 123.411 2.741 . . . . 0.0 114.369 177.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -66.53 -25.99 66.93 Favored 'General case' 0 CA--C 1.55 0.947 0 CA-C-N 119.793 1.178 . . . . 0.0 112.428 169.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 86.68 -27.27 5.94 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 125.619 1.58 . . . . 0.0 114.04 178.342 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -130.91 73.34 1.54 Allowed 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 122.849 1.309 . . . . 0.0 108.664 171.509 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 13.2 t0 178.99 136.57 0.09 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.907 2.083 . . . . 0.0 108.596 -173.676 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -148.59 152.23 36.4 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.86 0.864 . . . . 0.0 112.773 -168.062 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 -113.62 127.06 55.92 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.169 1.388 . . . . 0.0 109.63 168.387 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 2.4 mpt? -119.1 136.51 54.12 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.622 1.169 . . . . 0.0 109.684 -179.191 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 50.4 p -141.98 147.3 36.74 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 116.122 1.897 . . . . 0.0 116.122 -169.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 21.9 t -103.52 109.09 26.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 126.642 1.977 . . . . 0.0 107.302 170.021 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 91.9 t -76.11 127.55 37.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 124.493 1.117 . . . . 0.0 109.423 175.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 53.6 ttt85 53.88 59.5 4.24 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.147 1.379 . . . . 0.0 110.955 176.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.47 150.7 47.91 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.836 0.854 . . . . 0.0 112.434 -171.537 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.95 162.63 31.53 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.934 1.693 . . . . 0.0 110.686 -179.406 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 76.9 mtm180 -55.88 -22.37 25.11 Favored 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 114.474 1.287 . . . . 0.0 114.474 -177.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -55.28 -37.96 67.98 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.846 1.258 . . . . 0.0 112.835 168.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -80.97 -26.16 36.8 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.215 1.006 . . . . 0.0 113.096 -169.118 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 46.4 m -49.74 138.41 14.56 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.935 1.294 . . . . 0.0 112.963 178.177 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 155.7 -164.26 32.08 Favored Glycine 0 N--CA 1.472 1.037 0 C-N-CA 123.88 0.753 . . . . 0.0 113.198 -176.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 21.9 m -89.95 144.61 25.77 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.276 1.031 . . . . 0.0 109.293 175.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 34.2 m-85 -135.65 158.36 44.57 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.6 1.56 . . . . 0.0 112.174 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -160.87 151.9 18.74 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 124.953 1.301 . . . . 0.0 112.3 175.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 85.3 m -103.39 170.76 7.76 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.787 1.235 . . . . 0.0 110.969 173.073 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -164.82 140.24 6.3 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 121.258 -0.901 . . . . 0.0 114.078 172.215 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -104.34 142.98 33.61 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.562 1.145 . . . . 0.0 111.124 173.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.0 tt -145.47 134.42 17.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 124.209 1.003 . . . . 0.0 111.057 176.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 2.2 m -64.24 160.88 17.66 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.735 1.214 . . . . 0.0 112.828 -179.508 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 37.2 mt -72.46 -17.57 61.76 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 -178.19 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -69.1 148.92 97.77 Favored Pre-proline 0 CA--C 1.551 0.998 0 C-N-CA 124.522 1.129 . . . . 0.0 112.48 178.137 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -69.55 -20.29 36.0 Favored 'Trans proline' 0 CA--C 1.539 0.764 0 C-N-CA 123.144 2.563 . . . . 0.0 113.214 179.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -83.04 0.44 44.85 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 124.803 1.241 . . . . 0.0 113.97 178.126 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.9 167.98 14.56 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.126 1.371 . . . . 0.0 113.928 -175.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -145.77 152.01 38.87 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.81 1.644 . . . . 0.0 109.546 177.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 51.2 mt -75.57 126.95 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 124.187 0.995 . . . . 0.0 111.215 -174.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -78.4 88.49 4.4 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.767 1.227 . . . . 0.0 109.967 169.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -83.79 158.78 21.59 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.914 1.285 . . . . 0.0 111.154 175.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 6.7 t -148.61 -170.0 3.5 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.201 1.0 . . . . 0.0 112.152 173.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 98.8 mt -60.5 128.82 38.55 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.193 1.797 . . . . 0.0 111.754 -174.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.43 154.45 41.34 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.758 1.223 . . . . 0.0 112.73 -171.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.84 167.16 11.19 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 127.069 2.148 . . . . 0.0 110.234 174.239 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -135.06 143.41 46.68 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.026 -1.046 . . . . 0.0 111.781 179.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 60.6 tp -112.17 134.14 53.89 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 125.922 1.689 . . . . 0.0 110.3 172.49 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 70.8 ttt180 -124.87 117.96 25.26 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.501 1.52 . . . . 0.0 109.615 169.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 29.5 t -100.53 117.7 46.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 124.37 1.068 . . . . 0.0 108.685 169.605 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 66.8 p -97.44 154.65 17.34 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.698 1.599 . . . . 0.0 111.056 179.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -62.02 141.98 57.76 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.527 0.731 . . . . 0.0 112.629 -176.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 51.8 ttt85 . . . . . 0 N--CA 1.467 0.423 0 C-N-CA 123.914 0.885 . . . . 0.0 110.164 -178.005 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 37.8 m . . . . . 0 N--CA 1.474 0.748 0 CA-C-O 121.094 0.473 . . . . 0.0 111.378 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -116.8 129.23 55.97 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.6 1.96 . . . . 0.0 109.576 170.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 67.8 m -140.79 158.94 64.24 Favored Pre-proline 0 N--CA 1.479 0.98 0 C-N-CA 124.543 1.137 . . . . 0.0 113.14 -170.062 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -67.75 157.5 85.46 Favored 'Cis proline' 0 C--N 1.354 0.833 0 CA-C-N 119.938 1.014 . . . . 0.0 111.398 -5.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -55.03 -25.92 33.67 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.109 0.963 . . . . 0.0 113.5 176.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 43.3 tp -143.5 116.18 8.69 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.582 1.553 . . . . 0.0 108.441 168.698 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 38.0 tp -97.32 127.47 43.31 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.416 1.086 . . . . 0.0 109.018 169.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.8 t -114.04 123.14 69.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 124.067 0.947 . . . . 0.0 108.662 173.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 32.6 m -127.03 162.52 31.72 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 124.529 1.132 . . . . 0.0 112.134 174.013 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 11.6 m -87.52 148.65 24.82 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.378 1.071 . . . . 0.0 110.502 173.076 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -59.2 125.7 24.69 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.019 0.928 . . . . 0.0 111.753 -179.254 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.66 -3.49 85.02 Favored Glycine 0 CA--C 1.532 1.11 0 C-N-CA 125.805 1.669 . . . . 0.0 114.51 -175.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -85.35 156.03 21.07 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 119.601 1.7 . . . . 0.0 110.814 171.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -82.46 134.81 35.22 Favored 'General case' 0 CA--C 1.543 0.68 0 O-C-N 121.405 -0.809 . . . . 0.0 111.24 171.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -104.47 123.64 47.84 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.713 1.605 . . . . 0.0 110.052 177.342 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 94.7 m -122.9 125.22 44.93 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.41 0.684 . . . . 0.0 110.985 176.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -102.82 159.6 15.34 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 127.264 2.225 . . . . 0.0 110.522 174.363 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 80.6 m -105.71 130.08 53.79 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.854 1.261 . . . . 0.0 109.997 170.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 54.0 t -110.29 140.5 44.39 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.382 1.473 . . . . 0.0 109.814 168.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 6.1 t -144.38 132.24 21.38 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.355 -0.84 . . . . 0.0 110.534 -178.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 . . . . . 0 N--CA 1.468 0.449 0 C-N-CA 125.645 1.578 . . . . 0.0 113.636 -177.217 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 52.4 p90 . . . . . 0 CA--C 1.54 0.589 0 CA-C-O 120.407 0.146 . . . . 0.0 110.611 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 50.4 t -95.92 125.22 48.78 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.43 1.092 . . . . 0.0 108.268 174.098 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 58.6 tp -101.57 128.9 47.62 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.388 0.675 . . . . 0.0 109.557 169.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 28.8 m-80 -116.64 163.17 16.51 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.637 1.575 . . . . 0.0 111.154 -175.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 19.8 t90 -133.19 138.88 46.73 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.756 1.222 . . . . 0.0 111.832 -178.376 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -137.43 146.56 44.51 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.291 1.436 . . . . 0.0 113.717 -172.073 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 27.7 ttp-105 -104.12 142.62 34.17 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.949 1.7 . . . . 0.0 107.727 167.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 35.4 mtp -88.27 131.47 34.77 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 119.077 0.853 . . . . 0.0 111.027 170.075 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 37.9 m -92.65 155.56 41.84 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 124.807 1.243 . . . . 0.0 111.43 175.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -66.67 -19.32 53.88 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 123.566 2.844 . . . . 0.0 113.775 -175.22 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.7 m -76.94 8.54 3.69 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 124.753 1.221 . . . . 0.0 113.277 171.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 26.4 m120 73.29 21.01 3.13 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 127.851 2.46 . . . . 0.0 113.37 179.231 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 21.9 mm100 -96.7 175.37 6.4 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.669 1.187 . . . . 0.0 111.265 174.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.2 p -126.53 139.84 52.9 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.976 1.71 . . . . 0.0 109.795 175.251 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 41.3 t0 -120.57 130.68 54.31 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 125.323 1.449 . . . . 0.0 110.667 -177.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 41.7 tttm -82.79 123.12 29.04 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.454 1.102 . . . . 0.0 111.415 -171.435 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.5 mt -100.37 -45.65 5.51 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.77 1.228 . . . . 0.0 112.912 -169.069 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -174.05 176.71 2.5 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.337 1.855 . . . . 0.0 110.353 -178.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -157.75 166.29 33.15 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.959 1.303 . . . . 0.0 112.136 -179.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 21.2 t80 -142.17 122.24 8.18 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 125.087 1.355 . . . . 0.0 110.503 172.586 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo . . . . . 0 C--N 1.352 0.715 0 CA-C-N 119.534 0.869 . . . . 0.0 110.92 -9.363 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 50.6 mtp180 . . . . . 0 N--CA 1.473 0.684 0 CA-C-O 119.127 -0.464 . . . . 0.0 112.049 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 88.6 m-85 -103.23 128.3 50.27 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.554 1.542 . . . . 0.0 110.903 -175.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -142.02 148.04 37.86 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.766 1.227 . . . . 0.0 111.406 -170.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 40.9 t -126.62 136.9 59.47 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 124.976 1.311 . . . . 0.0 110.784 178.497 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 98.0 m -127.81 132.74 49.43 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.494 1.518 . . . . 0.0 110.212 175.312 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -85.12 136.48 33.53 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.08 0.952 . . . . 0.0 110.46 172.11 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 29.5 mt -89.59 159.25 44.22 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 124.135 0.974 . . . . 0.0 111.461 176.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -63.65 -6.03 9.83 Favored 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 123.489 2.793 . . . . 0.0 114.216 175.097 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -66.55 -18.99 65.67 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-N 119.224 0.92 . . . . 0.0 112.953 169.391 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 82.72 -34.18 2.76 Favored Glycine 0 N--CA 1.474 1.2 0 C-N-CA 127.386 2.422 . . . . 0.0 114.326 174.222 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 38.1 mtm105 -128.25 73.56 1.49 Allowed 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.097 1.359 . . . . 0.0 108.574 168.534 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -174.22 137.68 0.54 Allowed 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 127.743 2.417 . . . . 0.0 108.03 177.514 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -146.03 148.5 32.77 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 123.461 0.705 . . . . 0.0 112.209 -168.037 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 42.6 m170 -105.43 130.2 53.57 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.71 1.204 . . . . 0.0 111.203 169.325 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -112.0 119.31 38.04 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 126.311 1.844 . . . . 0.0 108.565 178.088 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 60.8 m -121.44 125.66 47.42 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 -169.479 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 25.8 t -96.35 111.11 25.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 125.773 1.629 . . . . 0.0 106.693 168.185 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 62.6 t -81.48 127.92 39.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 123.543 0.737 . . . . 0.0 109.766 177.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 68.0 ttt-85 57.15 67.61 0.96 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.821 1.649 . . . . 0.0 111.273 176.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -72.53 144.42 47.97 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.851 0.86 . . . . 0.0 112.289 -174.137 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 49.0 mmm-85 -123.15 162.23 22.91 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 126.625 1.97 . . . . 0.0 110.352 -177.092 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 77.2 mtm180 -55.66 -23.11 26.33 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 113.66 0.985 . . . . 0.0 113.66 174.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -54.06 -35.67 62.28 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.766 1.626 . . . . 0.0 113.586 168.271 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -87.69 -15.09 38.12 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.304 1.042 . . . . 0.0 113.72 -168.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 50.2 m -58.04 134.66 56.61 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 119.696 1.135 . . . . 0.0 112.273 177.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 146.94 -163.97 28.59 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 124.496 1.046 . . . . 0.0 113.316 -171.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.8 m -95.08 144.85 25.4 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.586 1.154 . . . . 0.0 111.783 -173.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -140.5 156.92 46.18 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.394 1.877 . . . . 0.0 112.254 -179.097 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -164.07 159.16 20.19 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.797 1.639 . . . . 0.0 112.372 179.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 7.3 p -112.49 162.99 15.0 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.543 1.137 . . . . 0.0 112.115 176.037 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -153.35 126.23 1.92 Allowed Glycine 0 N--CA 1.471 1.026 0 O-C-N 121.304 -0.872 . . . . 0.0 114.287 -176.569 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -97.23 148.78 22.75 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.484 1.114 . . . . 0.0 112.715 -177.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 17.8 tt -150.27 138.8 14.78 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 125.402 1.481 . . . . 0.0 110.532 175.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 47.4 t -65.2 158.15 26.91 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.451 -0.781 . . . . 0.0 112.72 176.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -71.76 -8.04 51.79 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 172.542 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -69.77 147.59 96.3 Favored Pre-proline 0 CA--C 1.552 1.04 0 C-N-CA 124.453 1.101 . . . . 0.0 112.275 175.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -71.02 -21.24 27.9 Favored 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 123.17 2.58 . . . . 0.0 113.311 -179.113 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -87.74 3.5 47.78 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.735 1.214 . . . . 0.0 113.821 179.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.76 167.31 17.42 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.147 1.379 . . . . 0.0 114.126 -173.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -150.45 148.86 29.26 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.221 1.808 . . . . 0.0 109.169 178.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 47.8 mt -77.15 131.12 35.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 124.219 1.008 . . . . 0.0 112.031 -170.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -101.32 117.11 34.31 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.594 1.557 . . . . 0.0 108.284 168.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -94.93 148.86 21.87 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.235 1.014 . . . . 0.0 112.134 -174.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 52.9 p -83.91 169.22 15.29 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.693 1.197 . . . . 0.0 114.074 178.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 94.5 mt -69.06 129.99 41.48 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 166.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 34.3 ptt-85 -84.68 164.15 18.79 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.931 1.292 . . . . 0.0 113.749 -169.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -146.93 163.13 37.14 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.283 1.433 . . . . 0.0 113.488 -177.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -99.13 151.48 20.93 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.726 1.61 . . . . 0.0 112.798 -176.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 61.5 tp -125.58 136.49 53.35 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 126.857 2.063 . . . . 0.0 109.851 169.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -128.11 120.46 27.44 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.7 1.6 . . . . 0.0 109.93 174.031 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 42.9 t -101.95 116.93 46.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 124.512 1.125 . . . . 0.0 108.752 169.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 82.8 p -101.98 145.37 29.37 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.653 1.581 . . . . 0.0 110.716 -178.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -55.36 145.22 22.78 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -175.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 63.7 ttt-85 . . . . . 0 N--CA 1.467 0.389 0 C-N-CA 125.209 1.404 . . . . 0.0 109.772 175.675 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.2 t . . . . . 0 N--CA 1.472 0.658 0 CA-C-O 121.503 0.668 . . . . 0.0 112.202 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -144.97 117.67 8.67 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.347 1.859 . . . . 0.0 109.619 175.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 96.9 p -140.94 161.72 52.29 Favored Pre-proline 0 CA--C 1.55 0.969 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 -169.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -71.71 164.26 84.65 Favored 'Cis proline' 0 C--N 1.354 0.826 0 CA-C-N 119.45 0.839 . . . . 0.0 111.762 -7.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.66 -26.06 68.49 Favored 'General case' 0 CA--C 1.544 0.75 0 N-CA-C 113.048 0.759 . . . . 0.0 113.048 173.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 50.7 tp -144.3 125.68 14.8 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.192 1.797 . . . . 0.0 109.326 172.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 64.7 tp -115.29 125.61 53.48 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.987 1.715 . . . . 0.0 109.266 174.304 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.9 t -110.25 122.98 65.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 124.144 0.978 . . . . 0.0 109.16 175.038 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 32.0 m -129.2 176.22 8.75 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 125.753 1.621 . . . . 0.0 111.861 176.456 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 26.1 m -103.95 151.68 22.88 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 126.08 1.752 . . . . 0.0 110.402 176.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -53.51 121.98 8.82 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.294 1.038 . . . . 0.0 111.777 171.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.0 2.36 69.1 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 125.442 1.496 . . . . 0.0 114.407 -177.089 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -93.85 149.37 21.29 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.665 1.732 . . . . 0.0 112.544 177.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 21.6 m120 -72.93 113.22 9.72 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.255 1.022 . . . . 0.0 110.757 172.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -97.5 124.99 41.92 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.79 0.836 . . . . 0.0 110.514 177.63 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 32.1 m -129.53 123.27 31.02 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 118.633 0.651 . . . . 0.0 111.53 -173.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -101.55 149.81 23.72 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.609 1.564 . . . . 0.0 110.371 169.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 62.1 m -102.67 126.34 49.73 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.985 1.314 . . . . 0.0 109.475 177.454 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 37.5 t -124.33 142.05 51.58 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.147 1.379 . . . . 0.0 112.314 175.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 80.7 p -150.59 148.79 29.07 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.146 -0.971 . . . . 0.0 112.133 170.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 . . . . . 0 CA--C 1.537 0.451 0 C-N-CA 126.822 2.049 . . . . 0.0 111.962 178.486 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 55.5 p90 . . . . . 0 CA--C 1.54 0.577 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.7 t -96.03 129.02 46.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 125.179 1.392 . . . . 0.0 107.995 170.058 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 34.1 tp -99.37 140.29 33.77 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.222 1.009 . . . . 0.0 109.968 171.294 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -135.49 146.37 48.08 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.337 1.455 . . . . 0.0 111.02 -170.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 17.3 t90 -118.37 139.9 50.67 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.031 1.332 . . . . 0.0 111.297 177.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -136.99 147.7 46.44 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.725 1.21 . . . . 0.0 113.783 -172.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 74.4 ttt180 -105.68 140.06 39.31 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.41 1.484 . . . . 0.0 108.315 167.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 29.8 mtp -81.82 145.92 30.16 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.011 0.823 . . . . 0.0 112.414 177.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 67.7 m -104.68 148.91 36.83 Favored Pre-proline 0 CA--C 1.544 0.745 0 C-N-CA 125.657 1.583 . . . . 0.0 110.793 173.408 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -67.16 -17.9 50.73 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 123.682 2.921 . . . . 0.0 113.278 -177.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 12.0 m -76.87 19.25 0.3 Allowed 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 125.759 1.624 . . . . 0.0 113.29 171.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 44.8 m-80 68.63 33.84 3.72 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 127.425 2.29 . . . . 0.0 112.587 177.01 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -130.06 -172.68 2.84 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.453 1.501 . . . . 0.0 110.798 -172.121 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.1 p -148.01 145.12 28.38 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.909 1.684 . . . . 0.0 110.215 -171.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -120.12 131.61 55.11 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 124.638 1.175 . . . . 0.0 111.002 175.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -76.17 129.51 36.85 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.561 0.744 . . . . 0.0 111.307 -179.359 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 55.7 mt -101.98 -51.25 3.45 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 125.473 1.509 . . . . 0.0 111.406 -173.165 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -163.4 173.55 13.05 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.822 1.649 . . . . 0.0 110.387 -175.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.6 168.39 26.21 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.508 1.123 . . . . 0.0 112.759 -174.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 52.3 t80 -142.73 122.8 7.98 Favored Pre-proline 0 CA--C 1.546 0.8 0 C-N-CA 124.992 1.317 . . . . 0.0 110.332 169.439 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo . . . . . 0 C--N 1.351 0.705 0 CA-C-N 119.683 0.922 . . . . 0.0 111.399 -8.648 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 . . . . . 0 N--CA 1.474 0.726 0 N-CA-C 113.693 0.997 . . . . 0.0 113.693 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -90.15 124.94 35.25 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.04 0.936 . . . . 0.0 112.944 -168.111 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 23.4 mmt85 -129.82 156.63 44.03 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.84 1.656 . . . . 0.0 111.831 178.137 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 87.7 t -126.6 130.53 71.69 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 C-N-CA 125.65 1.58 . . . . 0.0 109.771 169.774 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 97.8 m -126.0 132.0 52.11 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 125.08 1.352 . . . . 0.0 110.16 177.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 63.0 tt0 -84.64 138.02 32.93 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.597 1.159 . . . . 0.0 111.043 177.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 28.6 mt -91.55 162.37 31.78 Favored Pre-proline 0 CA--C 1.548 0.877 0 C-N-CA 124.102 0.961 . . . . 0.0 112.063 176.31 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -56.03 -20.88 32.02 Favored 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 124.213 3.276 . . . . 0.0 114.211 172.605 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 21.7 m120 -60.74 -18.44 54.6 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 176.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 90.48 -34.06 4.32 Favored Glycine 0 N--CA 1.474 1.196 0 C-N-CA 126.569 2.033 . . . . 0.0 114.549 169.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 26.0 ptt-85 -138.8 73.58 1.44 Allowed 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 123.883 1.802 . . . . 0.0 109.72 168.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -164.53 137.33 4.84 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 127.872 2.469 . . . . 0.0 106.52 -179.058 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -144.75 143.47 30.69 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -166.628 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -96.69 116.03 28.43 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.973 1.309 . . . . 0.0 110.322 168.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -94.55 108.05 20.01 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 126.558 1.943 . . . . 0.0 107.621 174.336 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 19.4 m -116.51 126.99 54.14 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.847 1.055 . . . . 0.0 113.847 -167.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 21.3 t -94.66 104.83 16.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 N-CA-C 106.722 -1.584 . . . . 0.0 106.722 168.051 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 81.0 t -70.4 121.08 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 124.647 1.179 . . . . 0.0 109.731 179.442 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 51.87 57.27 6.7 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.793 1.637 . . . . 0.0 112.039 176.32 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -59.57 140.04 56.66 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.254 1.422 . . . . 0.0 112.056 -173.086 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 19.8 mmm-85 -115.05 168.31 10.04 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.641 1.576 . . . . 0.0 110.508 177.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 59.0 mtp85 -51.2 -35.29 35.78 Favored 'General case' 0 N--CA 1.479 0.997 0 O-C-N 121.023 -1.048 . . . . 0.0 112.855 176.149 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -57.43 -22.59 44.26 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.14 1.776 . . . . 0.0 114.994 173.115 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -86.68 -10.88 52.78 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.774 1.229 . . . . 0.0 113.53 177.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 65.4 m -63.97 137.74 58.14 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 120.196 -1.565 . . . . 0.0 112.312 -179.435 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 152.23 -166.7 31.14 Favored Glycine 0 N--CA 1.47 0.901 0 C-N-CA 123.996 0.808 . . . . 0.0 113.298 -179.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.6 m -93.63 141.79 28.08 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.367 1.067 . . . . 0.0 110.467 -176.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -136.05 160.12 39.6 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.548 1.939 . . . . 0.0 110.972 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.7 pp -154.09 163.52 39.96 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 121.12 -0.988 . . . . 0.0 112.262 174.036 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 34.6 t -124.59 141.18 52.29 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.288 1.435 . . . . 0.0 110.494 -177.125 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -150.24 143.78 11.11 Favored Glycine 0 N--CA 1.47 0.96 0 N-CA-C 114.938 0.735 . . . . 0.0 114.938 -175.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -115.86 154.3 29.96 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.009 1.324 . . . . 0.0 113.04 -177.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 17.2 tt -146.64 133.29 13.85 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 125.344 1.458 . . . . 0.0 110.469 176.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 31.7 p -71.47 161.55 30.85 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.124 0.97 . . . . 0.0 113.427 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 47.3 mt -75.22 -3.42 32.98 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 114.233 1.197 . . . . 0.0 114.233 -179.047 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -67.8 151.69 96.97 Favored Pre-proline 0 CA--C 1.551 0.986 0 C-N-CA 124.729 1.212 . . . . 0.0 112.612 178.193 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -69.29 -23.9 32.43 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 122.939 2.426 . . . . 0.0 112.693 175.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 57.2 mtmt -92.39 10.28 30.61 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.247 1.419 . . . . 0.0 113.591 178.566 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -64.23 161.62 16.18 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.815 1.246 . . . . 0.0 114.014 -175.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 25.9 tt0 -147.07 149.02 32.26 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.02 1.728 . . . . 0.0 109.105 179.037 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 58.1 mt -77.21 123.93 34.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 123.181 0.592 . . . . 0.0 110.967 -176.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -93.99 137.84 32.76 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.506 1.522 . . . . 0.0 108.709 168.19 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -120.06 142.41 48.88 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.098 0.959 . . . . 0.0 111.797 -175.29 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 23.7 m -89.65 167.13 13.16 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.192 0.997 . . . . 0.0 112.251 169.56 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.4 139.38 58.21 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.12 0.968 . . . . 0.0 110.665 176.202 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.57 151.88 44.55 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -172.838 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.87 161.12 19.25 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.062 1.745 . . . . 0.0 111.347 174.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -120.95 135.46 55.2 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.036 1.334 . . . . 0.0 110.016 176.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 46.3 tp -107.79 128.82 54.93 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 125.622 1.569 . . . . 0.0 109.724 173.498 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 4.5 tpm_? -123.83 113.14 18.14 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.122 1.769 . . . . 0.0 109.203 177.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 16.3 t -106.85 114.48 46.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 123.628 0.771 . . . . 0.0 109.799 176.652 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 70.2 p -95.25 159.27 15.09 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.43 1.892 . . . . 0.0 111.593 -176.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -67.57 141.48 56.8 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.433 0.693 . . . . 0.0 112.168 -178.184 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 68.9 ttp85 . . . . . 0 N--CA 1.466 0.338 0 C-N-CA 124.419 1.088 . . . . 0.0 110.113 178.199 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 13.7 t . . . . . 0 N--CA 1.467 0.401 0 CA-C-O 121.433 0.635 . . . . 0.0 112.023 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -143.92 113.88 7.27 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 127.535 2.334 . . . . 0.0 107.982 178.332 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 95.1 p -140.83 159.61 61.71 Favored Pre-proline 0 CA--C 1.55 0.951 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 -168.662 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.22 161.72 84.06 Favored 'Cis proline' 0 C--N 1.355 0.916 0 CA-C-N 119.419 0.828 . . . . 0.0 111.598 -6.73 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.43 -27.86 69.29 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 175.062 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 tt -132.57 115.36 15.36 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 126.453 1.901 . . . . 0.0 108.71 173.847 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.7 tp -107.15 121.18 43.99 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.933 0.893 . . . . 0.0 109.63 172.092 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.0 t -106.38 125.54 62.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 124.132 0.973 . . . . 0.0 108.661 172.737 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.9 m -129.42 166.67 26.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 124.363 1.065 . . . . 0.0 111.422 169.804 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 73.6 m -88.76 150.33 23.0 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.26 1.024 . . . . 0.0 110.344 170.424 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -53.81 116.9 2.77 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.551 1.541 . . . . 0.0 111.313 173.335 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 89.67 8.31 67.82 Favored Glycine 0 CA--C 1.534 1.247 0 CA-C-O 118.547 -1.141 . . . . 0.0 114.62 -176.295 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -99.5 155.34 17.62 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 119.408 1.604 . . . . 0.0 111.96 171.484 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -78.5 119.56 21.96 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.99 0.916 . . . . 0.0 110.969 179.895 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -98.91 126.72 44.66 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.685 1.194 . . . . 0.0 110.749 175.941 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 97.7 m -132.78 125.6 30.49 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.774 0.83 . . . . 0.0 111.61 179.74 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -100.05 154.16 18.64 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.837 1.655 . . . . 0.0 109.441 168.191 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.3 m -106.52 134.26 49.93 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.689 1.195 . . . . 0.0 109.369 173.493 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 43.2 t -126.39 139.63 53.12 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.637 1.575 . . . . 0.0 111.959 176.156 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 99.2 p -151.23 153.38 34.79 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 121.437 -0.79 . . . . 0.0 112.132 170.594 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 . . . . . 0 CA--C 1.533 0.311 0 C-N-CA 125.787 1.635 . . . . 0.0 113.336 -174.778 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 35.6 p90 . . . . . 0 CA--C 1.538 0.489 0 CA-C-O 120.698 0.285 . . . . 0.0 110.784 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 79.2 t -95.87 123.14 47.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 170.091 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 22.3 tp -100.06 136.12 40.45 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.908 0.883 . . . . 0.0 109.776 176.564 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -130.71 154.69 47.68 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.689 1.596 . . . . 0.0 111.003 -169.746 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 19.3 t90 -130.9 137.68 49.43 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.755 1.222 . . . . 0.0 111.689 -177.351 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -136.15 146.43 46.89 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.53 1.132 . . . . 0.0 112.998 -173.058 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.6 ttt180 -103.71 140.88 37.0 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.962 1.305 . . . . 0.0 108.48 167.823 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 28.5 mtp -87.08 140.75 29.24 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.4 0.68 . . . . 0.0 111.931 176.719 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 48.6 m -91.94 157.62 40.98 Favored Pre-proline 0 CA--C 1.549 0.913 0 C-N-CA 124.714 1.206 . . . . 0.0 111.91 176.514 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -55.62 -34.01 88.85 Favored 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 123.957 3.104 . . . . 0.0 114.09 176.485 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.6 m -76.92 9.63 2.8 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.063 1.345 . . . . 0.0 113.855 176.935 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 26.5 m120 70.5 20.9 5.74 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 127.329 2.252 . . . . 0.0 113.386 -178.971 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -90.1 -172.67 3.57 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.555 1.142 . . . . 0.0 110.582 170.432 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.1 p -145.13 147.35 32.4 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.768 1.627 . . . . 0.0 110.488 -175.512 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -123.9 133.3 53.77 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 124.731 1.212 . . . . 0.0 111.235 174.16 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -79.92 118.8 22.0 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.916 0.886 . . . . 0.0 111.21 -178.03 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 61.8 mt -89.25 -53.75 4.42 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 125.002 1.321 . . . . 0.0 111.172 -173.709 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -165.4 172.15 12.55 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.854 1.662 . . . . 0.0 110.552 -174.797 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.59 167.81 27.6 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.27 1.428 . . . . 0.0 111.628 -178.094 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -156.22 135.08 7.67 Favored Pre-proline 0 CA--C 1.551 1.011 0 C-N-CA 123.998 0.919 . . . . 0.0 112.974 170.239 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo . . . . . 0 C--N 1.354 0.817 0 N-CA-C 108.98 -1.2 . . . . 0.0 108.98 -14.322 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 25.7 ptt-85 . . . . . 0 N--CA 1.471 0.581 0 N-CA-C 114.694 1.368 . . . . 0.0 114.694 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -91.02 117.74 29.82 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.47 1.108 . . . . 0.0 110.317 177.805 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -139.09 152.31 47.41 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.417 1.087 . . . . 0.0 112.343 -169.49 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 82.4 t -126.47 128.94 71.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 C-N-CA 125.841 1.656 . . . . 0.0 109.376 177.647 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 96.7 m -128.0 133.47 49.16 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.233 1.413 . . . . 0.0 110.332 -176.466 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -80.65 141.79 34.61 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.001 0.92 . . . . 0.0 112.136 176.608 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 27.2 mt -90.84 158.39 42.21 Favored Pre-proline 0 CA--C 1.545 0.764 0 C-N-CA 124.06 0.944 . . . . 0.0 111.456 172.172 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -65.23 -6.21 12.73 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.529 2.819 . . . . 0.0 114.18 174.623 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -63.0 -26.0 68.65 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 119.527 1.058 . . . . 0.0 112.66 169.436 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 98.69 -34.16 5.53 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 126.231 1.872 . . . . 0.0 114.379 172.611 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 40.6 mtm180 -136.22 73.65 1.47 Allowed 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 118.654 1.227 . . . . 0.0 109.837 170.41 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -168.81 139.83 2.49 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 128.254 2.622 . . . . 0.0 107.397 -176.861 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -143.44 149.85 38.19 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 114.457 1.28 . . . . 0.0 114.457 -167.92 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -102.08 128.67 48.45 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.622 1.569 . . . . 0.0 110.45 168.286 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -106.49 113.11 26.43 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 127.039 2.136 . . . . 0.0 108.071 176.11 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 52.9 m -121.88 132.42 54.56 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 114.817 1.414 . . . . 0.0 114.817 -167.763 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 21.9 t -102.04 104.43 16.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 167.469 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 88.1 t -69.59 126.99 30.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 123.725 0.81 . . . . 0.0 109.858 179.124 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 47.17 59.28 4.15 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.878 1.671 . . . . 0.0 112.327 177.854 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -59.92 137.7 58.01 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.049 1.34 . . . . 0.0 112.737 -170.018 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 36.5 mtp180 -100.01 158.49 15.79 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.914 1.685 . . . . 0.0 109.889 -176.91 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 20.1 mtp180 -58.92 -29.08 66.82 Favored 'General case' 0 N--CA 1.484 1.236 0 O-C-N 120.846 -1.159 . . . . 0.0 112.576 176.039 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -51.23 -30.53 17.72 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.534 1.934 . . . . 0.0 113.948 168.559 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 47.4 m-20 -90.3 -8.89 49.74 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.893 1.277 . . . . 0.0 113.119 -169.693 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 50.4 m -62.98 138.88 58.69 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.058 -1.026 . . . . 0.0 112.202 177.302 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 149.72 -170.15 29.87 Favored Glycine 0 N--CA 1.472 1.095 0 C-N-CA 124.669 1.128 . . . . 0.0 113.0 -177.029 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.6 m -89.34 140.98 28.96 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.136 0.974 . . . . 0.0 110.698 -177.517 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -132.15 160.98 34.46 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.949 2.1 . . . . 0.0 110.478 176.702 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -156.64 161.57 39.89 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.676 1.19 . . . . 0.0 112.33 175.496 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 23.6 t -113.81 151.36 32.17 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.685 1.594 . . . . 0.0 111.093 -178.006 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -152.57 136.8 5.56 Favored Glycine 0 N--CA 1.473 1.165 0 C-N-CA 124.082 0.848 . . . . 0.0 113.688 -179.529 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -111.33 153.81 25.44 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 118.352 1.076 . . . . 0.0 112.659 -179.22 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.8 tt -141.19 132.56 28.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.664 1.186 . . . . 0.0 110.44 170.414 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 29.6 t -65.22 161.57 19.04 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.805 1.242 . . . . 0.0 113.85 -175.216 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 3.1 pp -64.38 -12.65 44.83 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.445 1.498 . . . . 0.0 114.971 176.654 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -78.42 141.11 60.88 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 124.401 1.081 . . . . 0.0 112.398 -178.514 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_exo -56.59 -28.78 76.26 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.409 2.739 . . . . 0.0 114.319 173.203 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -81.92 -1.52 48.17 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.259 1.424 . . . . 0.0 113.861 -178.947 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.03 164.65 12.42 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 114.387 1.254 . . . . 0.0 114.387 -174.478 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -145.03 154.78 42.88 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.419 1.888 . . . . 0.0 108.81 176.466 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 55.8 mt -72.86 121.63 23.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 123.62 0.768 . . . . 0.0 111.328 -173.887 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -92.72 123.61 36.12 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.084 1.754 . . . . 0.0 108.944 169.071 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -87.31 145.2 26.44 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.818 0.847 . . . . 0.0 111.96 -179.005 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 5.2 t -92.77 -165.45 1.34 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.055 1.342 . . . . 0.0 112.002 170.065 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 87.3 mt -68.2 158.94 32.13 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.015 1.326 . . . . 0.0 111.206 169.895 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.29 147.46 31.42 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.76 1.224 . . . . 0.0 111.209 170.14 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -144.3 155.77 43.97 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.588 1.555 . . . . 0.0 111.342 -177.734 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -102.87 141.39 35.75 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 178.582 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 54.7 tp -99.6 131.75 45.39 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 126.836 2.054 . . . . 0.0 108.662 168.956 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 28.7 ttm180 -127.28 110.84 13.25 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.703 1.601 . . . . 0.0 109.429 -179.989 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 42.6 t -101.37 116.47 45.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 124.501 1.12 . . . . 0.0 108.84 177.519 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 72.8 p -98.1 147.79 24.2 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.628 1.571 . . . . 0.0 110.652 -178.635 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -59.53 139.81 56.82 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.267 0.627 . . . . 0.0 111.76 -177.824 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 79.1 ttt-85 . . . . . 0 C--O 1.236 0.353 0 C-N-CA 123.794 0.837 . . . . 0.0 110.311 -178.397 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.7 t . . . . . 0 N--CA 1.472 0.67 0 CA-C-O 120.993 0.425 . . . . 0.0 111.576 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -161.85 111.99 1.59 Allowed 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 126.034 1.734 . . . . 0.0 109.873 177.584 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 90.0 p -141.03 161.55 53.06 Favored Pre-proline 0 CA--C 1.549 0.918 0 C-N-CA 124.618 1.167 . . . . 0.0 114.097 -174.643 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -75.71 162.83 91.61 Favored 'Cis proline' 0 C--N 1.352 0.746 0 CA-C-N 118.952 0.662 . . . . 0.0 111.456 -10.073 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.69 -25.88 67.52 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 171.868 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 40.4 tp -140.51 118.83 12.1 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 125.907 1.683 . . . . 0.0 109.012 170.688 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 50.6 tp -103.56 129.64 50.83 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.817 1.247 . . . . 0.0 109.127 169.971 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 14.0 p -112.78 128.99 69.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 123.931 0.892 . . . . 0.0 110.271 170.05 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 27.5 m -128.47 166.43 25.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 125.47 1.508 . . . . 0.0 111.865 172.911 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.6 m -90.98 148.43 22.42 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.828 1.251 . . . . 0.0 110.38 173.511 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -54.24 122.03 9.45 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.395 1.478 . . . . 0.0 111.533 176.906 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.73 -1.44 78.47 Favored Glycine 0 CA--C 1.535 1.303 0 C-N-CA 125.585 1.564 . . . . 0.0 114.897 -176.972 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -88.94 159.41 17.66 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.439 1.62 . . . . 0.0 111.381 171.748 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -87.84 135.06 33.55 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.533 -0.729 . . . . 0.0 111.474 171.476 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -108.02 129.91 55.1 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.909 1.683 . . . . 0.0 110.534 179.346 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 39.5 m -132.88 130.22 39.42 Favored 'General case' 0 N--CA 1.476 0.866 0 CA-C-N 119.256 0.935 . . . . 0.0 112.032 178.908 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -102.03 157.66 16.71 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.798 2.039 . . . . 0.0 110.894 172.259 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 46.8 m -113.02 139.75 48.41 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 125.994 1.718 . . . . 0.0 110.058 178.571 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 53.6 t -150.34 149.36 29.98 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.068 1.347 . . . . 0.0 113.08 -177.608 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 8.1 t -154.1 161.76 41.67 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.597 1.159 . . . . 0.0 112.56 169.38 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 . . . . . 0 N--CA 1.47 0.561 0 C-N-CA 126.946 2.098 . . . . 0.0 112.228 -178.314 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 54.6 p90 . . . . . 0 CA--C 1.537 0.46 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.1 t -106.87 136.57 41.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 126.1 1.76 . . . . 0.0 106.917 167.689 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.6 tt -109.64 134.94 51.36 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.509 0.723 . . . . 0.0 109.777 174.845 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.442 HD21 HG22 ' A' ' 126' ' ' ILE . 2.4 m-80 -133.35 160.92 35.92 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -166.14 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 67.2 t-105 -115.54 131.65 56.87 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 126.532 1.933 . . . . 0.0 110.877 169.593 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -122.53 156.29 34.48 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.052 1.341 . . . . 0.0 111.956 179.298 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 43.6 ttt-85 -112.84 142.84 45.03 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 126.06 1.744 . . . . 0.0 109.871 169.451 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 67.2 mmm -75.78 142.52 42.3 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.84 0.856 . . . . 0.0 112.384 173.843 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.7 p -90.76 163.61 29.41 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 124.585 1.154 . . . . 0.0 111.101 168.698 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -69.66 -11.09 30.23 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 122.903 2.402 . . . . 0.0 113.086 173.204 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.0 t -94.78 8.09 43.74 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.879 1.272 . . . . 0.0 112.401 172.883 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 64.2 t30 68.84 21.89 7.46 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.744 2.018 . . . . 0.0 113.096 -178.635 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -93.19 -175.05 3.72 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.286 1.034 . . . . 0.0 109.502 169.382 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 11.9 p -138.94 150.41 45.88 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.278 1.031 . . . . 0.0 112.004 -172.859 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -133.96 133.8 41.79 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.081 0.953 . . . . 0.0 111.816 173.403 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -77.3 127.91 33.41 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.735 0.814 . . . . 0.0 111.502 -178.019 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 18.9 mt -106.56 -32.07 8.22 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.901 0.881 . . . . 0.0 113.296 178.65 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -154.57 161.45 41.61 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.303 1.441 . . . . 0.0 111.87 -177.056 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.57 166.31 31.05 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.503 1.121 . . . . 0.0 113.23 -179.133 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -144.24 114.28 5.31 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 126.544 1.937 . . . . 0.0 109.597 174.619 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo . . . . . 0 CA--C 1.538 0.707 0 CA-C-N 119.546 0.874 . . . . 0.0 112.761 -11.128 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 36.3 mtp-105 . . . . . 0 N--CA 1.47 0.525 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -85.21 139.32 31.75 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.444 1.098 . . . . 0.0 109.808 171.935 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 83.2 mtm180 -144.44 149.36 35.9 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.25 1.42 . . . . 0.0 111.605 -173.568 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 77.8 t -126.54 130.93 71.76 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 125.377 1.471 . . . . 0.0 108.409 168.988 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 58.7 m -128.82 138.76 52.24 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.871 1.268 . . . . 0.0 110.59 -174.85 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 27.0 tt0 -97.86 136.62 37.9 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.689 1.195 . . . . 0.0 110.215 170.898 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -97.36 159.87 30.19 Favored Pre-proline 0 CA--C 1.546 0.812 0 C-N-CA 125.427 1.491 . . . . 0.0 111.489 -170.431 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -66.68 -11.1 30.5 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 123.593 2.862 . . . . 0.0 114.056 -178.405 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 22.2 m120 -66.29 -19.33 65.79 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 119.087 0.858 . . . . 0.0 113.052 170.548 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 91.16 -33.87 4.53 Favored Glycine 0 N--CA 1.474 1.229 0 C-N-CA 126.391 1.948 . . . . 0.0 114.377 169.934 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 95.4 mtm-85 -129.06 73.72 1.53 Allowed 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.718 1.607 . . . . 0.0 108.659 169.594 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -170.15 141.6 2.13 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 127.341 2.257 . . . . 0.0 109.278 -178.787 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -145.46 150.36 36.34 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.624 0.726 . . . . 0.0 112.613 -169.725 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -118.98 149.49 41.53 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.421 1.488 . . . . 0.0 111.373 171.321 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.5 mpt? -128.4 124.93 37.54 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.191 0.996 . . . . 0.0 109.358 171.37 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.1 t -124.6 148.29 47.96 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -168.817 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 17.0 t -125.09 105.94 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 127.128 2.171 . . . . 0.0 107.817 176.001 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 96.1 t -80.06 131.43 34.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 124.362 1.065 . . . . 0.0 111.152 -174.997 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 48.8 ttt85 53.4 61.3 3.2 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.917 1.687 . . . . 0.0 111.278 176.002 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.4 129.31 39.56 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.426 1.091 . . . . 0.0 110.844 -172.964 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 12.7 mmt-85 -100.6 167.99 9.99 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.765 1.626 . . . . 0.0 109.511 174.464 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 90.9 mtm-85 -55.56 -34.47 64.78 Favored 'General case' 0 N--CA 1.479 1.015 0 O-C-N 120.922 -1.111 . . . . 0.0 113.009 -178.877 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 34.5 t30 -62.1 -23.79 66.74 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.395 1.478 . . . . 0.0 114.514 174.87 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -80.36 -5.72 56.86 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.087 0.955 . . . . 0.0 112.82 176.258 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 24.4 m -65.49 136.43 56.42 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 120.405 -1.434 . . . . 0.0 110.99 169.943 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 160.07 -165.44 34.76 Favored Glycine 0 N--CA 1.467 0.732 0 O-C-N 121.558 -0.714 . . . . 0.0 113.241 -177.267 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.1 m -107.87 132.22 53.68 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.088 0.955 . . . . 0.0 110.338 -175.933 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -140.71 168.11 20.58 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.661 1.585 . . . . 0.0 111.759 -174.123 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -159.99 151.02 19.25 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 115.013 1.486 . . . . 0.0 115.013 -177.034 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 46.4 t -88.77 136.96 32.73 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.964 2.106 . . . . 0.0 111.275 173.814 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -159.02 135.19 4.08 Favored Glycine 0 N--CA 1.475 1.249 0 N-CA-C 115.402 0.921 . . . . 0.0 115.402 174.859 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -99.0 159.21 15.12 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.34 1.456 . . . . 0.0 112.501 176.393 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.442 HG22 HD21 ' A' ' 66' ' ' ASN . 19.0 tt -150.97 134.78 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 125.245 1.418 . . . . 0.0 110.749 178.539 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 41.7 t -64.69 159.66 21.65 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.057 0.943 . . . . 0.0 113.105 177.279 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 44.1 mt -75.51 -12.15 60.17 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.298 0.851 . . . . 0.0 113.298 172.324 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -65.14 147.01 98.84 Favored Pre-proline 0 CA--C 1.552 1.03 0 C-N-CA 124.036 0.934 . . . . 0.0 112.775 -179.432 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -56.5 -30.32 81.91 Favored 'Trans proline' 0 C--N 1.354 0.836 0 C-N-CA 123.511 2.807 . . . . 0.0 114.208 174.142 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 60.2 mtpt -88.35 5.98 39.43 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.193 1.397 . . . . 0.0 113.975 -178.197 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -61.18 153.31 26.33 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 -173.617 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -137.06 159.05 43.04 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.396 1.878 . . . . 0.0 108.744 174.365 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 45.2 mt -78.82 123.7 36.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 O-C-N 121.72 -0.613 . . . . 0.0 110.572 -175.939 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -97.03 104.06 16.04 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 126.106 1.762 . . . . 0.0 108.251 169.065 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -123.06 158.81 29.78 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.994 1.318 . . . . 0.0 113.868 -169.056 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 53.3 m -97.92 159.08 15.16 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.373 1.069 . . . . 0.0 112.14 171.748 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 10.6 mp -63.7 130.39 44.03 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.951 0.9 . . . . 0.0 110.953 -177.674 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.21 145.69 36.4 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.85 1.426 . . . . 0.0 114.85 -170.046 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -125.91 162.89 24.16 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.739 2.015 . . . . 0.0 112.067 -176.259 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -106.31 141.48 37.57 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.938 1.295 . . . . 0.0 112.375 -172.406 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 52.5 tp -115.41 131.58 56.89 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 126.332 1.853 . . . . 0.0 109.114 169.656 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 62.3 ttm-85 -124.07 123.48 40.42 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.794 1.638 . . . . 0.0 110.367 177.638 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 40.0 t -107.8 114.02 45.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 125.037 1.335 . . . . 0.0 109.272 172.676 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 73.0 p -95.11 152.2 18.55 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.509 1.524 . . . . 0.0 110.705 178.142 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -60.02 144.54 49.08 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.617 0.767 . . . . 0.0 112.679 -176.698 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 31.7 tpt85 . . . . . 0 C--O 1.235 0.312 0 C-N-CA 124.269 1.028 . . . . 0.0 109.239 175.624 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.9 t . . . . . 0 N--CA 1.481 1.123 0 CA-C-O 120.317 0.103 . . . . 0.0 111.211 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -125.03 133.64 52.87 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.803 1.641 . . . . 0.0 110.121 -178.538 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 93.6 p -140.96 155.19 68.95 Favored Pre-proline 0 CA--C 1.551 0.981 0 N-CA-C 114.511 1.3 . . . . 0.0 114.511 -176.756 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -68.96 162.03 82.66 Favored 'Cis proline' 0 C--N 1.353 0.766 0 CA-C-N 119.101 0.715 . . . . 0.0 111.511 -7.422 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.33 -32.61 70.24 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 122.803 0.441 . . . . 0.0 112.169 173.119 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 50.1 tp -140.23 120.41 13.81 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 125.452 1.501 . . . . 0.0 109.294 171.175 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 55.8 tp -100.6 125.89 47.02 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.439 1.496 . . . . 0.0 109.003 170.104 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.8 t -108.82 125.64 65.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 171.203 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 27.7 m -128.69 163.4 33.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 124.775 1.23 . . . . 0.0 110.83 173.014 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 52.7 m -88.21 146.95 25.1 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.592 0.757 . . . . 0.0 110.097 169.911 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -54.36 123.04 11.73 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.289 1.436 . . . . 0.0 111.074 174.822 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.08 3.52 72.97 Favored Glycine 0 CA--C 1.532 1.111 0 C-N-CA 125.863 1.697 . . . . 0.0 114.9 -174.733 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -90.26 157.02 17.88 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 119.612 1.706 . . . . 0.0 111.376 169.214 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -85.49 119.77 26.21 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.763 0.825 . . . . 0.0 109.957 174.628 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -98.84 129.62 45.23 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.466 1.107 . . . . 0.0 110.752 -179.246 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 89.9 m -132.73 131.46 41.24 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 119.352 0.978 . . . . 0.0 111.692 177.392 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -102.93 155.93 18.02 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.381 1.873 . . . . 0.0 111.089 172.52 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.6 m -98.68 136.03 39.32 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 125.402 1.481 . . . . 0.0 107.887 168.874 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 35.7 t -138.1 124.68 20.83 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 124.639 1.176 . . . . 0.0 110.308 -179.704 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 75.6 m -116.14 143.89 44.88 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 124.228 1.011 . . . . 0.0 111.094 -173.219 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 . . . . . 0 N--CA 1.465 0.288 0 C-N-CA 125.185 1.394 . . . . 0.0 113.694 170.026 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 53.9 p90 . . . . . 0 CA--C 1.538 0.514 0 CA-C-O 120.946 0.403 . . . . 0.0 111.946 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.6 t -95.98 128.24 47.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 171.466 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -112.77 118.67 35.61 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 125.379 1.471 . . . . 0.0 108.687 -177.123 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -116.48 155.24 28.96 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.921 1.688 . . . . 0.0 111.636 -169.438 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 13.6 t90 -124.32 138.57 54.37 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.726 1.211 . . . . 0.0 112.29 179.941 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 53.7 m-85 -136.65 145.61 45.01 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.031 1.333 . . . . 0.0 113.528 -174.973 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 78.9 ttt-85 -106.42 142.0 36.8 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.683 1.593 . . . . 0.0 108.414 167.833 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 37.1 mtp -86.73 145.37 26.69 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 119.034 0.833 . . . . 0.0 112.624 177.864 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.6 m -92.41 159.13 37.57 Favored Pre-proline 0 CA--C 1.547 0.86 0 C-N-CA 125.056 1.342 . . . . 0.0 111.999 175.755 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -57.79 -25.73 70.23 Favored 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 124.102 3.201 . . . . 0.0 114.224 174.412 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 33.5 p -77.06 -0.56 25.11 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.474 1.91 . . . . 0.0 114.017 174.943 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 71.16 20.87 4.99 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 127.178 2.191 . . . . 0.0 112.442 -173.111 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 20.5 mm100 -88.3 -172.67 3.88 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.033 0.933 . . . . 0.0 110.083 168.99 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.7 p -141.35 150.1 42.0 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.761 1.624 . . . . 0.0 110.628 -175.817 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -128.15 132.26 48.91 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.786 1.234 . . . . 0.0 111.032 176.909 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 57.0 tttt -79.76 132.47 36.17 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.372 0.669 . . . . 0.0 111.644 -176.639 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 67.9 mt -106.88 -46.09 4.03 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.077 1.351 . . . . 0.0 112.487 -169.921 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -174.15 175.95 2.61 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 127.175 2.19 . . . . 0.0 110.089 -174.478 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.63 167.7 27.83 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.888 1.275 . . . . 0.0 112.318 -179.363 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.461 ' CG ' ' HA ' ' A' ' 83' ' ' PRO . 54.7 t80 -129.33 144.0 51.06 Favored Pre-proline 0 CA--C 1.549 0.909 0 C-N-CA 126.181 1.792 . . . . 0.0 110.226 169.808 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.461 ' HA ' ' CG ' ' A' ' 82' ' ' PHE . 68.4 Cg_exo . . . . . 0 C--N 1.356 0.969 0 N-CA-C 116.352 1.635 . . . . 0.0 116.352 2.755 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 46.5 mtp85 . . . . . 0 N--CA 1.471 0.582 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 -101.43 142.32 32.99 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.139 1.775 . . . . 0.0 112.013 -172.673 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 65.3 ttt180 -143.48 144.36 31.96 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.63 1.572 . . . . 0.0 111.27 178.475 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 57.6 t -120.34 132.56 69.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 125.663 1.585 . . . . 0.0 109.08 169.707 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 25.0 m -126.66 133.79 50.89 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.922 1.289 . . . . 0.0 109.858 177.11 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -84.86 138.38 32.58 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.398 0.679 . . . . 0.0 110.67 172.481 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 41.5 mt -85.07 159.61 56.65 Favored Pre-proline 0 CA--C 1.544 0.717 0 C-N-CA 124.863 1.265 . . . . 0.0 111.771 179.247 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -63.03 -5.91 8.61 Favored 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 123.675 2.917 . . . . 0.0 113.95 174.012 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 23.2 m120 -60.93 -25.22 66.62 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.191 0.996 . . . . 0.0 112.852 169.251 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 89.23 -16.51 55.67 Favored Glycine 0 N--CA 1.476 1.308 0 C-N-CA 125.53 1.538 . . . . 0.0 114.768 174.427 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.6 ptp180 -154.57 73.69 0.91 Allowed 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 126.198 1.799 . . . . 0.0 109.487 169.816 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -173.73 148.67 1.5 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 128.378 2.671 . . . . 0.0 108.55 -178.642 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -146.66 153.48 40.35 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.796 1.035 . . . . 0.0 113.796 -166.844 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -116.33 141.75 47.75 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.887 1.675 . . . . 0.0 110.065 168.115 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 42.5 mtt -130.73 115.29 16.45 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 124.629 1.172 . . . . 0.0 110.546 -173.924 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 43.7 m -116.02 134.03 55.39 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.36 1.245 . . . . 0.0 114.36 -167.749 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 17.1 t -104.56 113.72 42.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 126.569 1.948 . . . . 0.0 106.825 167.865 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 4.0 p -77.48 133.61 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 122.513 0.325 . . . . 0.0 110.755 -179.911 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 45.92 64.11 1.59 Allowed 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 125.491 1.516 . . . . 0.0 112.08 174.12 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.02 144.41 57.3 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.368 1.067 . . . . 0.0 112.994 -169.694 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 54.3 mtp85 -114.87 158.33 22.1 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 126.598 1.959 . . . . 0.0 110.036 -176.393 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 91.0 mtm-85 -53.6 -32.62 51.87 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 -178.833 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -70.84 -18.82 62.7 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 115.676 1.732 . . . . 0.0 115.676 176.613 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -73.2 -25.55 60.81 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 119.566 1.076 . . . . 0.0 112.045 178.769 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 14.8 m -51.35 139.44 19.32 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.979 1.312 . . . . 0.0 112.905 178.923 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 152.09 -166.6 31.04 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 124.338 0.971 . . . . 0.0 113.023 -175.777 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.5 m -92.36 143.88 25.94 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.9 1.28 . . . . 0.0 110.167 -179.617 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -138.39 156.55 47.49 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.931 1.692 . . . . 0.0 111.719 -177.606 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -163.06 157.09 20.34 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.06 1.344 . . . . 0.0 112.4 177.527 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 5.6 m -100.51 162.98 12.57 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.997 0.919 . . . . 0.0 111.85 172.724 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -145.21 130.19 3.76 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 124.392 0.996 . . . . 0.0 112.163 169.437 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -111.65 145.0 40.0 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 118.41 1.105 . . . . 0.0 112.327 178.437 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.4 tt -141.34 133.58 29.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.236 1.414 . . . . 0.0 110.125 179.405 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 53.2 p -71.48 161.62 30.74 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 -176.594 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -58.44 -15.49 11.09 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 115.372 1.619 . . . . 0.0 115.372 177.399 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -70.56 136.6 85.96 Favored Pre-proline 0 CA--C 1.552 1.027 0 C-N-CA 125.047 1.339 . . . . 0.0 112.244 -178.359 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_exo -57.07 -27.89 76.12 Favored 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 123.426 2.751 . . . . 0.0 114.066 172.631 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 14.5 tppt? -84.4 1.73 43.94 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 125.395 1.478 . . . . 0.0 113.997 -177.916 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -67.11 161.41 24.64 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -172.959 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 28.0 mp0 -128.09 159.15 35.99 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.794 2.037 . . . . 0.0 108.983 170.72 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 42.4 mt -82.83 120.44 34.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 123.509 0.723 . . . . 0.0 110.597 178.868 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 15.3 ptpt -90.99 143.76 26.38 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.421 1.089 . . . . 0.0 111.241 168.648 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -140.07 158.79 43.5 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 126.255 1.822 . . . . 0.0 110.351 -173.222 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 6.2 t -136.74 -166.67 1.94 Allowed 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.269 1.028 . . . . 0.0 112.871 -179.985 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 96.4 mt -62.7 124.77 21.86 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.268 1.827 . . . . 0.0 112.423 -170.371 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 73.6 mtm-85 -62.23 151.36 36.45 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.817 1.647 . . . . 0.0 113.507 -173.965 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.89 166.26 12.17 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.668 1.987 . . . . 0.0 110.846 173.33 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -133.85 146.24 50.42 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.422 1.089 . . . . 0.0 111.996 178.727 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 59.5 tp -113.86 137.11 52.12 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 126.182 1.793 . . . . 0.0 110.201 173.051 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 61.9 ttm-85 -127.81 120.18 27.28 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 125.522 1.529 . . . . 0.0 109.699 169.412 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 43.5 t -104.32 113.35 41.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 124.786 1.234 . . . . 0.0 108.742 173.144 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 53.8 p -95.05 140.88 29.38 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.349 1.459 . . . . 0.0 110.039 -178.697 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 4.2 pm0 -61.96 144.32 55.24 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.729 0.812 . . . . 0.0 112.855 -172.406 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 45.3 ttt85 . . . . . 0 N--CA 1.468 0.437 0 C-N-CA 124.049 0.939 . . . . 0.0 110.837 -170.399 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 86.7 m . . . . . 0 N--CA 1.472 0.648 0 CA-C-O 121.438 0.637 . . . . 0.0 110.944 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -114.11 124.32 51.8 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.97 2.108 . . . . 0.0 108.11 169.318 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 88.0 p -140.75 156.09 69.05 Favored Pre-proline 0 CA--C 1.549 0.916 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -169.156 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -66.68 161.18 75.84 Favored 'Cis proline' 0 C--N 1.355 0.894 0 CA-C-N 119.84 0.979 . . . . 0.0 112.111 -2.457 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.81 -27.5 66.65 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 177.75 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 49.1 tp -141.15 122.54 14.93 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.365 1.466 . . . . 0.0 108.749 169.835 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 59.5 tp -106.16 126.06 51.75 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.157 1.383 . . . . 0.0 109.057 170.869 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.3 t -109.68 124.43 66.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 123.864 0.866 . . . . 0.0 108.798 172.998 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 33.7 m -128.66 172.43 15.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 C-N-CA 124.919 1.287 . . . . 0.0 110.951 171.43 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 66.2 m -104.48 151.92 22.98 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.516 1.526 . . . . 0.0 110.313 170.971 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -44.29 124.63 4.12 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.313 1.445 . . . . 0.0 112.967 172.357 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 89.99 -2.37 81.68 Favored Glycine 0 CA--C 1.531 1.048 0 C-N-CA 125.732 1.634 . . . . 0.0 114.484 -179.261 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -89.31 153.82 20.58 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.699 1.75 . . . . 0.0 111.909 174.367 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -80.81 118.25 22.17 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.588 0.755 . . . . 0.0 110.355 174.806 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -97.32 114.26 26.02 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.074 0.95 . . . . 0.0 110.533 178.978 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 46.9 m -122.35 124.19 43.13 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.936 0.895 . . . . 0.0 111.4 -175.288 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -102.45 158.16 16.41 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 126.646 1.978 . . . . 0.0 110.742 171.683 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 86.1 m -101.63 135.05 43.8 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.13 1.372 . . . . 0.0 109.551 169.861 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 42.7 t -113.7 132.79 55.67 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.611 1.564 . . . . 0.0 110.691 169.631 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 67.3 m -126.55 122.13 34.24 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.948 0.899 . . . . 0.0 110.852 179.574 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 24.8 m-85 . . . . . 0 N--CA 1.47 0.528 0 C-N-CA 126.701 2.0 . . . . 0.0 110.682 169.515 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 52.1 p90 . . . . . 0 CA--C 1.54 0.566 0 CA-C-O 120.481 0.181 . . . . 0.0 110.774 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 58.2 t -95.94 129.35 46.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 C-N-CA 124.503 1.121 . . . . 0.0 108.24 175.29 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 19.4 tp -107.59 139.72 41.7 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.417 1.087 . . . . 0.0 109.923 172.592 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 13.6 m-80 -132.78 149.84 52.23 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.524 1.529 . . . . 0.0 111.107 -168.997 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 18.3 t90 -121.73 137.89 54.58 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.035 1.334 . . . . 0.0 111.617 -179.055 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -137.43 145.33 43.03 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 -172.836 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -102.03 139.76 37.22 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.021 1.328 . . . . 0.0 108.274 167.01 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 32.8 mtp -84.26 142.75 30.02 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.107 0.867 . . . . 0.0 112.11 176.862 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 45.6 m -91.17 158.4 41.41 Favored Pre-proline 0 CA--C 1.548 0.883 0 C-N-CA 124.843 1.257 . . . . 0.0 111.68 174.867 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -55.43 -33.45 85.89 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 123.947 3.098 . . . . 0.0 114.346 177.245 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.3 m -76.99 6.31 6.52 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.904 1.282 . . . . 0.0 113.895 177.374 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 74.02 20.93 2.69 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 127.208 2.203 . . . . 0.0 112.895 -178.188 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 20.7 mm100 -88.63 -172.89 3.92 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.185 0.994 . . . . 0.0 110.258 169.658 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.6 p -145.48 142.69 29.47 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.663 1.585 . . . . 0.0 110.323 -174.805 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -119.93 130.55 54.85 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 124.578 1.151 . . . . 0.0 111.17 175.493 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -77.97 125.75 29.81 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.364 1.065 . . . . 0.0 111.089 -177.12 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 55.7 mt -99.81 -49.31 4.4 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 125.172 1.389 . . . . 0.0 111.278 -172.658 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -162.6 173.16 14.3 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.249 1.819 . . . . 0.0 110.479 -178.006 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.18 163.34 36.11 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.074 1.35 . . . . 0.0 111.733 -178.215 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -145.62 124.08 6.52 Favored Pre-proline 0 CA--C 1.546 0.825 0 C-N-CA 124.833 1.253 . . . . 0.0 110.676 172.229 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo . . . . . 0 CA--C 1.538 0.681 0 CA-C-N 119.48 0.85 . . . . 0.0 112.761 -12.949 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 41.6 mmm-85 . . . . . 0 CA--C 1.536 0.433 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 -108.05 135.3 49.64 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.789 1.236 . . . . 0.0 111.046 177.82 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 49.7 ttp180 -138.11 136.95 37.23 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.679 1.591 . . . . 0.0 110.609 -176.242 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 87.3 t -126.43 130.25 71.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 C-N-CA 125.633 1.573 . . . . 0.0 109.157 175.579 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 87.1 m -130.58 130.34 43.92 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.117 1.367 . . . . 0.0 110.281 -176.363 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -82.87 133.97 35.11 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.16 0.984 . . . . 0.0 110.195 173.652 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 28.4 mt -86.63 160.33 50.67 Favored Pre-proline 0 CA--C 1.543 0.697 0 C-N-CA 123.587 0.755 . . . . 0.0 111.339 176.659 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -62.49 -8.23 12.44 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 123.374 2.716 . . . . 0.0 114.187 174.75 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -65.77 -22.34 66.57 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-N 119.207 0.912 . . . . 0.0 112.602 169.271 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 80.66 -34.33 2.3 Favored Glycine 0 N--CA 1.473 1.167 0 C-N-CA 128.232 2.825 . . . . 0.0 113.914 175.871 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? -122.62 73.64 1.14 Allowed 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.743 1.617 . . . . 0.0 108.663 168.191 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -177.64 140.82 0.27 Allowed 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 128.495 2.718 . . . . 0.0 108.432 176.651 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -143.64 153.26 42.33 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 -168.666 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 21.4 m170 -108.67 131.72 54.63 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.341 1.456 . . . . 0.0 110.845 168.556 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -113.95 120.25 40.03 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 126.612 1.965 . . . . 0.0 108.157 176.691 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.2 t -128.31 127.17 42.22 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -168.383 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 47.8 t -91.17 116.39 32.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 125.441 1.496 . . . . 0.0 107.08 169.117 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 61.0 t -83.96 120.26 34.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 124.637 1.175 . . . . 0.0 109.638 -175.784 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 52.15 65.73 1.42 Allowed 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.228 1.811 . . . . 0.0 111.567 179.167 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.66 147.59 51.65 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.717 1.207 . . . . 0.0 112.628 -171.507 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 54.7 mmm-85 -122.72 165.31 16.75 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.971 1.709 . . . . 0.0 110.578 178.475 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 34.9 mtp180 -55.11 -33.88 63.21 Favored 'General case' 0 N--CA 1.483 1.217 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 -173.15 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -62.12 -18.54 61.13 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 125.241 1.417 . . . . 0.0 114.637 175.28 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 -81.21 -12.65 59.11 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 119.582 1.083 . . . . 0.0 113.316 176.903 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 20.9 m -62.64 138.63 58.54 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 119.517 1.053 . . . . 0.0 112.438 -179.486 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 154.74 -166.93 32.53 Favored Glycine 0 N--CA 1.473 1.124 0 O-C-N 121.377 -0.827 . . . . 0.0 113.611 -177.033 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 6.4 m -93.9 144.35 25.52 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.334 1.054 . . . . 0.0 110.366 -178.844 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 68.9 m-85 -142.96 155.51 44.7 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.354 1.461 . . . . 0.0 111.681 -177.989 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.4 pp -153.5 173.43 15.71 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.37 1.068 . . . . 0.0 112.593 177.933 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 28.1 t -125.6 156.13 39.63 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.813 1.645 . . . . 0.0 110.316 -176.209 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -152.74 137.02 5.64 Favored Glycine 0 N--CA 1.47 0.931 0 O-C-N 121.197 -0.939 . . . . 0.0 114.677 -179.188 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -110.02 152.1 26.34 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.736 1.214 . . . . 0.0 112.721 -179.506 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.5 tt -152.13 135.44 7.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 125.55 1.54 . . . . 0.0 110.442 173.634 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 33.7 m -67.04 159.65 28.26 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.775 0.83 . . . . 0.0 112.91 179.452 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 2.3 pp -72.05 -7.93 51.68 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 115.406 1.632 . . . . 0.0 115.406 -176.861 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -80.8 148.59 65.46 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 124.71 1.204 . . . . 0.0 112.082 177.156 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -68.66 -19.79 41.37 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 123.245 2.63 . . . . 0.0 113.355 -179.924 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -77.37 -9.56 58.92 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.798 1.239 . . . . 0.0 113.665 177.12 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.86 162.85 20.77 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.004 1.322 . . . . 0.0 113.785 -175.765 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -138.21 154.72 49.1 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.011 1.724 . . . . 0.0 109.368 175.857 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 45.8 mt -79.27 126.66 39.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 123.345 0.658 . . . . 0.0 110.838 -175.687 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -102.6 129.09 49.06 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.223 1.409 . . . . 0.0 109.38 169.375 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -104.11 149.42 25.24 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.742 1.217 . . . . 0.0 111.842 -174.386 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 88.1 p -91.62 170.03 10.26 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.661 1.356 . . . . 0.0 114.661 178.81 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 87.8 mt -68.27 127.77 34.13 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.033 0.933 . . . . 0.0 109.471 168.809 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.1 166.88 20.47 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 115.236 1.569 . . . . 0.0 115.236 -169.602 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -126.35 168.78 13.69 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.842 2.057 . . . . 0.0 111.234 169.574 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -120.57 142.16 49.62 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.301 1.44 . . . . 0.0 110.89 173.007 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 51.4 tp -110.16 131.24 55.23 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 126.082 1.753 . . . . 0.0 109.791 171.852 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -121.78 117.66 27.11 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.674 1.59 . . . . 0.0 109.395 169.955 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 39.5 t -104.18 111.84 35.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 C-N-CA 124.225 1.01 . . . . 0.0 108.665 170.949 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 71.8 p -86.69 151.3 23.53 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 126.087 1.755 . . . . 0.0 110.28 179.564 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -63.09 149.29 45.52 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.811 0.844 . . . . 0.0 112.805 -175.142 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 56.8 ttp180 . . . . . 0 C--O 1.236 0.366 0 C-N-CA 124.517 1.127 . . . . 0.0 109.697 -174.21 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 37.3 p . . . . . 0 N--CA 1.479 0.975 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -121.93 134.39 54.84 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.382 1.473 . . . . 0.0 109.912 173.936 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.9 m -140.85 156.39 68.73 Favored Pre-proline 0 N--CA 1.479 1.016 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 179.523 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -70.17 158.16 92.51 Favored 'Cis proline' 0 C--N 1.352 0.733 0 CA-C-N 119.494 0.855 . . . . 0.0 110.926 -8.646 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -56.96 -32.01 65.6 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 172.715 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 49.2 tp -139.13 121.17 15.66 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.351 1.46 . . . . 0.0 109.322 170.031 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 49.4 tp -102.19 126.93 49.3 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.351 1.46 . . . . 0.0 109.205 171.019 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.6 t -110.75 124.64 67.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 124.081 0.952 . . . . 0.0 108.454 172.011 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 36.0 m -127.52 168.83 19.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 124.618 1.167 . . . . 0.0 111.677 174.174 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 44.0 m -94.54 146.41 24.12 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.869 1.267 . . . . 0.0 110.151 170.915 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -57.13 117.65 4.24 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.474 1.51 . . . . 0.0 111.867 -178.973 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 100.26 -2.9 56.53 Favored Glycine 0 CA--C 1.534 1.268 0 C-N-CA 125.919 1.723 . . . . 0.0 114.58 -175.937 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -86.21 157.27 20.01 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.232 1.516 . . . . 0.0 112.286 173.988 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -83.25 113.48 20.71 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.006 0.923 . . . . 0.0 110.44 175.773 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -95.82 116.63 29.19 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.101 0.961 . . . . 0.0 110.837 -178.754 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 36.1 m -121.5 127.49 51.09 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.763 0.825 . . . . 0.0 111.558 -177.014 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -100.66 150.42 22.75 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.07 1.748 . . . . 0.0 110.896 170.625 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 27.3 m -93.15 137.88 32.08 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 125.917 1.687 . . . . 0.0 108.179 169.337 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 42.9 t -143.88 131.19 20.85 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.9 1.28 . . . . 0.0 110.37 -176.356 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.9 t -128.27 136.09 50.54 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 121.321 -0.862 . . . . 0.0 112.058 -169.663 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 . . . . . 0 CA--C 1.535 0.382 0 C-N-CA 125.786 1.634 . . . . 0.0 113.464 174.504 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 54.4 p90 . . . . . 0 CA--C 1.538 0.499 0 CA-C-O 120.947 0.403 . . . . 0.0 111.787 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.4 t -95.95 129.39 46.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 125.204 1.402 . . . . 0.0 107.275 172.927 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 57.8 tp -99.39 134.72 41.85 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 124.167 0.987 . . . . 0.0 109.528 173.984 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 -127.84 155.39 44.2 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.107 1.363 . . . . 0.0 110.641 -177.922 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 10.1 t90 -125.36 137.3 54.03 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.634 1.174 . . . . 0.0 111.628 178.868 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -132.81 150.93 52.11 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.228 1.411 . . . . 0.0 113.347 -176.392 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -112.73 141.5 46.45 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.794 1.638 . . . . 0.0 109.178 168.992 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 81.2 mmm -74.19 133.39 42.73 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.057 0.543 . . . . 0.0 111.34 173.755 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 50.0 m -86.04 157.52 56.85 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 124.65 1.18 . . . . 0.0 111.783 172.807 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -57.57 -28.25 80.34 Favored 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 123.905 3.07 . . . . 0.0 114.284 174.97 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 25.2 p -77.03 3.81 11.51 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 126.022 1.729 . . . . 0.0 114.033 174.868 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 67.53 20.96 9.65 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 127.308 2.243 . . . . 0.0 112.932 -174.021 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -90.13 -172.65 3.56 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.958 1.303 . . . . 0.0 109.925 169.045 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.0 p -138.98 145.65 39.97 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.025 1.33 . . . . 0.0 110.347 -177.717 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -122.67 134.56 54.48 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 123.775 0.83 . . . . 0.0 111.569 173.154 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -75.23 137.52 41.3 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.96 0.904 . . . . 0.0 111.174 179.406 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 52.0 mt -114.55 -39.78 3.73 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.384 1.474 . . . . 0.0 112.865 -169.916 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -171.7 175.29 4.03 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.619 1.968 . . . . 0.0 110.175 -176.126 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -157.06 167.72 29.61 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.936 1.294 . . . . 0.0 112.096 179.844 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -145.23 115.44 4.99 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 125.76 1.624 . . . . 0.0 109.378 169.345 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_exo . . . . . 0 C--N 1.352 0.713 0 CA-C-N 120.22 1.114 . . . . 0.0 113.546 -5.573 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 30.4 ptt-85 . . . . . 0 CA--C 1.536 0.425 0 N-CA-C 113.893 1.072 . . . . 0.0 113.893 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 84.6 m-85 -93.83 123.41 37.16 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.488 1.115 . . . . 0.0 110.013 176.078 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -139.02 144.68 38.98 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.146 0.978 . . . . 0.0 111.645 -175.267 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 57.5 t -126.55 126.73 69.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 125.36 1.464 . . . . 0.0 109.379 -179.428 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 86.4 m -130.53 137.75 49.87 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.876 1.271 . . . . 0.0 110.421 -176.109 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -82.17 141.93 32.63 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.358 0.599 . . . . 0.0 112.459 172.249 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 39.2 mt -77.9 161.05 72.67 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 123.419 0.687 . . . . 0.0 110.898 169.37 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -68.37 -4.16 12.32 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 123.435 2.757 . . . . 0.0 113.562 171.699 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.81 -23.05 65.98 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 124.33 1.052 . . . . 0.0 112.494 172.005 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 93.66 -18.43 56.52 Favored Glycine 0 N--CA 1.477 1.428 0 C-N-CA 125.646 1.593 . . . . 0.0 114.715 170.695 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 27.1 ptt180 -154.59 73.66 0.91 Allowed 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 126.085 1.754 . . . . 0.0 109.204 170.08 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -173.8 147.53 1.36 Allowed 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 128.308 2.643 . . . . 0.0 108.462 -178.461 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 25.0 m-85 -146.86 157.08 43.56 Favored 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 113.958 1.096 . . . . 0.0 113.958 -166.383 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -116.55 143.09 46.04 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.193 1.797 . . . . 0.0 110.744 169.014 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 39.8 mtt -126.85 120.64 29.74 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.975 1.31 . . . . 0.0 109.95 177.615 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 69.0 m -120.42 128.21 52.98 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 114.263 1.208 . . . . 0.0 114.263 -168.041 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 21.6 t -94.6 98.88 8.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 N-CA-C 105.958 -1.868 . . . . 0.0 105.958 167.017 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 92.8 t -70.5 125.43 28.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.597 1.159 . . . . 0.0 109.182 -179.035 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 75.8 ttt180 52.35 65.59 1.46 Allowed 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.21 1.404 . . . . 0.0 110.929 179.181 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.26 130.57 43.29 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 121.327 -0.858 . . . . 0.0 111.721 -172.281 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 8.1 mpt_? -95.3 161.83 13.93 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.594 1.558 . . . . 0.0 110.086 175.266 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 89.8 mtm-85 -53.4 -36.92 61.98 Favored 'General case' 0 N--CA 1.482 1.141 0 O-C-N 121.151 -0.968 . . . . 0.0 112.708 179.732 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -62.35 -16.03 51.94 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.045 1.738 . . . . 0.0 114.845 176.264 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -80.53 -11.16 59.7 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 119.958 1.254 . . . . 0.0 113.272 176.234 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 21.2 m -63.91 132.23 50.12 Favored 'General case' 0 N--CA 1.477 0.878 0 O-C-N 120.534 -1.354 . . . . 0.0 112.586 -179.803 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 158.96 -167.32 34.79 Favored Glycine 0 N--CA 1.472 1.042 0 O-C-N 121.162 -0.961 . . . . 0.0 113.725 -177.68 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.2 m -93.4 138.31 31.86 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.888 1.275 . . . . 0.0 110.721 -178.045 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -135.9 156.46 48.73 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.804 1.641 . . . . 0.0 112.556 -177.647 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -160.25 148.62 16.82 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.808 1.243 . . . . 0.0 112.332 179.184 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 4.5 m -89.13 170.49 10.57 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.293 0.568 . . . . 0.0 111.999 172.49 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -155.04 115.6 0.67 Allowed Glycine 0 CA--C 1.526 0.765 0 C-N-CA 124.532 1.063 . . . . 0.0 111.673 168.435 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -87.82 156.26 19.48 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 117.791 0.795 . . . . 0.0 111.638 172.458 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 17.8 tt -154.43 130.19 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 124.602 1.161 . . . . 0.0 110.791 174.297 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 22.8 m -67.92 159.28 30.85 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.648 1.179 . . . . 0.0 113.402 -178.25 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.81 -9.91 48.34 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 115.578 1.696 . . . . 0.0 115.578 179.012 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -75.05 142.93 76.65 Favored Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 124.335 1.054 . . . . 0.0 112.265 -179.142 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_exo -56.14 -27.75 66.96 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 123.607 2.871 . . . . 0.0 114.658 174.736 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -84.51 0.98 47.78 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.819 1.248 . . . . 0.0 114.309 -179.49 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.88 164.52 17.26 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 124.4 1.08 . . . . 0.0 113.683 -177.213 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -146.1 152.44 39.31 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.76 1.624 . . . . 0.0 109.424 178.681 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 64.9 mt -71.46 123.37 25.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 124.28 1.032 . . . . 0.0 111.023 -174.774 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -83.72 88.38 7.07 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.451 1.501 . . . . 0.0 110.742 178.268 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -74.86 152.86 38.88 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.882 0.873 . . . . 0.0 110.566 171.353 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 58.8 m -157.35 -177.39 6.56 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.104 1.362 . . . . 0.0 112.24 179.528 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.5 tt -55.65 106.96 0.29 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.316 1.846 . . . . 0.0 113.083 -170.627 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.33 156.52 15.54 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.8 1.64 . . . . 0.0 114.762 -175.538 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -118.77 169.65 9.66 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 126.865 2.066 . . . . 0.0 111.558 177.559 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -130.82 144.94 51.81 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.844 1.257 . . . . 0.0 111.821 179.605 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 55.1 tp -115.21 134.8 54.81 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 126.417 1.887 . . . . 0.0 110.178 173.771 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 60.0 ttt85 -125.9 120.62 30.89 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.791 1.636 . . . . 0.0 109.755 171.207 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 46.6 t -106.43 114.71 46.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 124.833 1.253 . . . . 0.0 108.763 174.9 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 70.3 p -98.64 146.04 26.25 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.948 1.699 . . . . 0.0 110.416 -177.972 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 -59.05 146.98 36.48 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -172.355 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 20.0 ttp-105 . . . . . 0 C--O 1.236 0.345 0 C-N-CA 124.594 1.158 . . . . 0.0 108.803 -176.036 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.2 t . . . . . 0 N--CA 1.474 0.754 0 N-CA-C 112.016 0.376 . . . . 0.0 112.016 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -129.45 132.92 47.07 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.002 1.721 . . . . 0.0 110.761 -171.05 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 92.8 p -140.86 154.99 69.22 Favored Pre-proline 0 CA--C 1.55 0.98 0 N-CA-C 113.893 1.071 . . . . 0.0 113.893 -172.283 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -66.98 160.07 79.03 Favored 'Cis proline' 0 C--N 1.353 0.804 0 CA-C-N 119.409 0.825 . . . . 0.0 111.497 -6.405 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.86 -28.68 66.33 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 176.521 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 47.8 tp -141.13 122.59 15.01 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.586 1.554 . . . . 0.0 109.049 170.252 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 54.6 tp -105.84 126.11 51.79 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.033 1.333 . . . . 0.0 109.32 170.926 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.4 t -109.08 123.77 65.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 124.028 0.931 . . . . 0.0 108.915 173.164 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.3 m -127.93 170.05 18.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 125.047 1.339 . . . . 0.0 111.474 172.86 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 18.4 m -98.16 151.74 20.1 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.472 1.509 . . . . 0.0 110.39 173.856 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -47.92 127.48 12.11 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.568 1.147 . . . . 0.0 111.45 168.777 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 86.24 -1.05 87.55 Favored Glycine 0 CA--C 1.532 1.137 0 C-N-CA 125.306 1.431 . . . . 0.0 114.664 -178.044 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.5 t0 -89.14 160.3 17.07 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.664 1.732 . . . . 0.0 111.912 173.786 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 71.4 m-20 -93.68 118.71 31.75 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.418 1.087 . . . . 0.0 110.191 175.343 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -97.88 120.44 38.28 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.875 1.27 . . . . 0.0 110.791 -179.992 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 23.1 m -125.38 125.82 44.03 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.593 0.757 . . . . 0.0 111.049 178.99 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -102.31 159.36 15.48 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.2 1.8 . . . . 0.0 111.034 172.078 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 71.3 m -113.4 126.82 55.77 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.722 1.609 . . . . 0.0 109.375 175.848 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -118.3 127.62 53.88 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.91 1.284 . . . . 0.0 111.525 179.012 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 57.6 m -118.91 139.36 51.77 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.983 1.313 . . . . 0.0 109.877 -172.278 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.427 ' CE1' HD21 ' A' ' 65' ' ' LEU . 38.1 m-85 . . . . . 0 CA--C 1.536 0.42 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -169.651 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 30.8 p90 . . . . . 0 CA--C 1.538 0.514 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 57.6 t -95.99 132.59 39.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 125.482 1.513 . . . . 0.0 107.038 167.465 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.427 HD21 ' CE1' ' A' ' 56' ' ' PHE . 0.2 OUTLIER -99.31 113.48 25.81 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.849 0.86 . . . . 0.0 109.256 176.31 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 35.0 m120 -106.19 145.97 30.86 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.153 1.381 . . . . 0.0 111.177 179.91 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 18.5 t90 -114.83 136.36 53.18 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.669 1.188 . . . . 0.0 111.018 176.511 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -130.1 145.18 51.67 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.83 1.252 . . . . 0.0 113.998 -173.012 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 52.3 ttp85 -101.12 144.45 29.99 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 126.409 1.884 . . . . 0.0 107.64 167.017 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 33.5 mtp -90.26 145.79 24.73 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 118.948 0.794 . . . . 0.0 112.212 173.507 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 41.2 m -111.45 149.88 41.29 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 125.649 1.58 . . . . 0.0 111.071 173.805 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -69.32 -14.54 37.66 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 124.333 3.356 . . . . 0.0 114.164 -170.424 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.2 m -76.79 10.39 2.26 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.687 1.195 . . . . 0.0 112.929 171.162 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 68.15 48.82 0.9 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 127.434 2.294 . . . . 0.0 111.021 -176.565 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 26.9 mm-40 -130.72 175.71 8.8 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.441 1.496 . . . . 0.0 110.736 -178.523 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.0 p -136.13 150.99 49.32 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.938 1.695 . . . . 0.0 111.107 -177.354 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 39.6 t0 -133.99 127.72 32.93 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.573 1.549 . . . . 0.0 110.745 -177.798 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 30.6 ttmt -74.23 129.05 37.08 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.689 0.796 . . . . 0.0 110.734 -178.917 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 78.4 mt -101.35 -49.09 4.16 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 125.159 1.384 . . . . 0.0 112.294 -175.147 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -165.78 176.74 7.71 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 127.044 2.137 . . . . 0.0 109.409 -178.853 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -157.44 167.22 30.84 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.767 0.827 . . . . 0.0 113.003 -176.87 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -139.52 117.0 8.56 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 125.557 1.543 . . . . 0.0 109.4 169.405 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo . . . . . 0 C--N 1.352 0.73 0 CA-C-N 120.502 1.215 . . . . 0.0 113.656 -6.302 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 12.5 mmt85 . . . . . 0 N--CA 1.474 0.759 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -111.91 136.3 51.4 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.064 1.746 . . . . 0.0 110.081 174.311 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 12.1 mtm180 -144.52 149.26 35.61 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.7 1.2 . . . . 0.0 112.715 179.108 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 43.9 t -126.5 131.19 71.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 C-N-CA 125.69 1.596 . . . . 0.0 109.652 175.713 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 89.1 m -130.5 136.45 48.98 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.728 1.211 . . . . 0.0 110.407 178.269 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -80.28 141.89 35.08 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 118.566 0.621 . . . . 0.0 112.081 174.759 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 19.6 mt -85.48 158.62 57.15 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 123.751 0.82 . . . . 0.0 111.271 169.75 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -66.15 -4.55 10.58 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 123.656 2.904 . . . . 0.0 114.201 174.306 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -61.13 -26.15 67.48 Favored 'General case' 0 CA--C 1.551 1.007 0 CA-C-N 119.49 1.041 . . . . 0.0 112.835 169.699 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 98.73 -34.07 5.6 Favored Glycine 0 CA--C 1.531 1.078 0 C-N-CA 126.113 1.816 . . . . 0.0 114.224 172.708 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 57.1 mtm180 -135.36 73.59 1.48 Allowed 'General case' 0 N--CA 1.475 0.785 0 CA-C-O 122.616 1.198 . . . . 0.0 109.589 169.314 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -168.19 143.9 3.75 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 127.337 2.255 . . . . 0.0 108.651 -179.735 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -145.76 148.21 32.73 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.736 0.815 . . . . 0.0 112.833 -167.691 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -104.66 129.17 52.86 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.076 1.351 . . . . 0.0 110.673 168.827 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.4 mpt? -113.21 114.02 26.16 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 126.252 1.821 . . . . 0.0 108.987 -178.924 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 34.7 t -118.91 126.82 52.66 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.768 1.025 . . . . 0.0 113.768 -169.348 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 22.8 t -101.0 113.04 35.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 167.838 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 3.6 m -89.29 139.28 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-N 118.506 0.594 . . . . 0.0 111.864 179.424 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 19.9 tpt180 56.07 51.37 12.03 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.129 1.772 . . . . 0.0 111.712 173.658 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.12 158.96 24.49 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 114.589 1.329 . . . . 0.0 114.589 -168.81 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 4.8 ptm180 -135.77 151.83 50.5 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 127.816 2.446 . . . . 0.0 109.605 -172.159 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 36.1 mtp180 -53.35 -37.55 62.48 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 114.387 1.254 . . . . 0.0 114.387 -169.628 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -65.43 -13.79 59.49 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 125.053 1.341 . . . . 0.0 114.546 177.217 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -72.49 -16.69 61.79 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.978 1.263 . . . . 0.0 112.689 172.96 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.6 m -62.05 132.8 54.08 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.073 -1.017 . . . . 0.0 112.505 -177.388 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 159.76 -167.09 35.19 Favored Glycine 0 N--CA 1.473 1.112 0 C-N-CA 124.227 0.918 . . . . 0.0 114.031 -174.654 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.9 m -94.46 144.46 25.54 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.274 1.43 . . . . 0.0 110.977 -178.032 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -144.65 155.08 43.42 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.588 1.555 . . . . 0.0 111.789 -175.375 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -160.65 161.58 32.45 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.94 1.296 . . . . 0.0 113.441 179.511 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 3.5 m -104.67 162.74 13.02 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.342 1.457 . . . . 0.0 111.449 179.057 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -153.19 134.52 4.46 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 123.89 0.757 . . . . 0.0 113.369 169.883 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -99.27 126.78 45.17 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.981 0.913 . . . . 0.0 110.777 173.64 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 16.7 tt -122.28 131.36 73.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 O-C-N 121.266 -0.896 . . . . 0.0 110.857 174.888 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.2 m -61.22 157.96 15.11 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.515 1.126 . . . . 0.0 113.151 -177.92 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 39.0 mt -73.15 -14.23 61.33 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 -178.752 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -69.55 154.3 94.95 Favored Pre-proline 0 CA--C 1.552 1.055 0 C-N-CA 125.061 1.344 . . . . 0.0 112.821 176.097 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.87 -24.69 24.29 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 123.011 2.474 . . . . 0.0 112.975 176.958 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 17.2 ttpp -89.09 13.36 13.25 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 125.248 1.419 . . . . 0.0 113.461 -179.433 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.78 168.08 10.21 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.564 1.546 . . . . 0.0 114.754 -173.64 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -142.97 147.67 35.57 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.209 1.804 . . . . 0.0 109.219 177.372 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 42.8 mt -80.83 125.1 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 123.995 0.918 . . . . 0.0 111.006 -175.04 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 32.2 mmtm -88.05 93.92 9.64 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.955 1.302 . . . . 0.0 107.983 169.361 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -79.24 139.64 37.86 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.621 0.769 . . . . 0.0 112.021 -174.178 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 69.4 m -84.5 156.06 21.88 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.395 1.078 . . . . 0.0 113.33 175.073 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 89.0 mt -62.2 135.75 57.63 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 168.44 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.82 165.14 25.46 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 115.428 1.64 . . . . 0.0 115.428 -169.679 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -129.59 169.53 14.91 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 127.07 2.148 . . . . 0.0 110.55 169.548 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -122.46 142.33 50.67 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.818 1.247 . . . . 0.0 111.477 176.651 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 60.7 tp -110.34 136.27 49.77 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 125.946 1.698 . . . . 0.0 109.91 172.012 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 68.2 ttt180 -127.61 121.66 31.1 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.682 1.593 . . . . 0.0 109.756 170.07 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 45.2 t -108.0 111.85 37.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 C-N-CA 124.977 1.311 . . . . 0.0 108.641 172.755 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 75.4 p -90.8 155.2 18.96 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 125.945 1.698 . . . . 0.0 110.694 -179.647 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -65.21 148.9 50.86 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.946 0.898 . . . . 0.0 113.385 -172.463 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 34.2 ttp-105 . . . . . 0 C--O 1.236 0.362 0 C-N-CA 124.602 1.161 . . . . 0.0 109.828 -175.405 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.8 t . . . . . 0 N--CA 1.466 0.374 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -121.24 144.02 48.83 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.418 1.087 . . . . 0.0 112.301 -168.459 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 79.9 p -140.91 153.88 67.92 Favored Pre-proline 0 CA--C 1.547 0.85 0 N-CA-C 113.728 1.011 . . . . 0.0 113.728 168.732 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -70.43 159.92 90.9 Favored 'Cis proline' 0 C--N 1.352 0.738 0 CA-C-N 118.96 0.664 . . . . 0.0 111.092 -10.066 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.57 -30.44 69.79 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 173.05 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 48.0 tp -138.52 120.26 15.25 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.52 1.528 . . . . 0.0 109.005 170.103 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 41.8 tp -102.01 127.16 49.0 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.132 1.373 . . . . 0.0 109.403 172.781 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.8 t -112.43 123.1 67.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 124.022 0.929 . . . . 0.0 108.925 173.57 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.5 m -128.5 166.38 25.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 C-N-CA 124.687 1.195 . . . . 0.0 112.195 173.55 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.0 m -88.51 150.11 23.28 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.938 1.295 . . . . 0.0 110.522 172.339 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -51.73 124.95 13.6 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.587 1.155 . . . . 0.0 111.639 173.684 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 86.25 -0.87 87.48 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 124.849 1.214 . . . . 0.0 114.593 -178.412 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -85.62 158.92 19.97 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 119.598 1.699 . . . . 0.0 111.52 171.428 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 8.0 p30 -86.02 130.05 34.65 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.506 0.722 . . . . 0.0 111.276 172.145 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -111.07 119.58 39.5 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.325 1.45 . . . . 0.0 110.76 -178.161 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 34.4 m -120.55 125.57 48.15 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.985 0.914 . . . . 0.0 111.675 -176.482 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -99.99 153.12 19.45 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.739 1.615 . . . . 0.0 110.406 169.126 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 37.2 m -103.8 131.35 51.07 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.27 1.428 . . . . 0.0 108.858 171.583 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 46.4 t -121.29 124.21 44.06 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.979 1.312 . . . . 0.0 111.082 171.521 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 24.0 t -125.26 146.3 49.61 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.161 1.385 . . . . 0.0 111.181 179.964 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 34.6 p90 . . . . . 0 N--CA 1.472 0.672 0 C-N-CA 125.07 1.348 . . . . 0.0 112.188 -170.042 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 5.0 p90 . . . . . 0 CA--C 1.539 0.521 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 48.0 t -109.61 137.85 39.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 126.286 1.834 . . . . 0.0 108.52 170.866 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 15.9 tp -102.94 130.79 50.12 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 123.641 0.776 . . . . 0.0 109.619 170.074 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -126.08 158.07 36.39 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.358 1.463 . . . . 0.0 111.568 -171.495 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 15.2 t90 -130.5 138.62 50.34 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.435 1.094 . . . . 0.0 112.149 -176.761 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -139.82 147.73 41.15 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.518 1.127 . . . . 0.0 113.436 -171.928 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 79.4 ttt-85 -110.93 138.29 47.51 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.542 1.537 . . . . 0.0 108.852 168.519 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 37.7 mtp -86.39 145.9 26.68 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 119.348 0.976 . . . . 0.0 112.492 177.046 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.1 p -86.01 163.0 44.98 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 123.824 0.849 . . . . 0.0 111.929 170.689 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -67.53 -19.45 48.59 Favored 'Trans proline' 0 C--N 1.354 0.85 0 C-N-CA 122.639 2.226 . . . . 0.0 112.575 171.574 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 21.9 m -82.41 12.54 4.38 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.135 1.374 . . . . 0.0 112.806 170.029 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . 0.312 0.4 OUTLIER 61.58 21.71 12.32 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 128.252 2.621 . . . . 0.0 115.574 179.185 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 17.7 mm100 -89.25 -172.68 3.73 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.072 0.949 . . . . 0.0 109.634 168.858 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.4 p -141.59 141.83 33.47 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.601 1.561 . . . . 0.0 110.318 -174.897 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -118.01 131.44 56.48 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 125.026 1.33 . . . . 0.0 110.369 175.582 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 55.4 tttm -83.07 119.42 24.46 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.554 1.141 . . . . 0.0 110.744 -174.285 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 74.6 mt -92.56 -49.45 6.1 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 124.731 1.213 . . . . 0.0 112.313 -169.206 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -172.55 175.32 3.53 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 127.005 2.122 . . . . 0.0 109.982 -173.206 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.61 172.15 18.32 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.992 1.317 . . . . 0.0 112.2 -178.686 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -143.5 118.42 6.24 Favored Pre-proline 0 CA--C 1.547 0.838 0 C-N-CA 124.809 1.244 . . . . 0.0 110.279 169.102 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo . . . . . 0 C--N 1.351 0.708 0 CA-C-N 119.154 0.733 . . . . 0.0 111.192 -10.183 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 84.4 mtt-85 . . . . . 0 N--CA 1.466 0.371 0 CA-C-O 118.72 -0.657 . . . . 0.0 112.647 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -91.7 116.35 28.81 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.454 1.101 . . . . 0.0 111.345 -169.65 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 -137.81 139.66 40.11 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.165 0.986 . . . . 0.0 111.029 -170.455 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 97.2 t -126.5 125.53 67.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 125.288 1.435 . . . . 0.0 109.487 -177.889 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 90.7 m -130.28 129.39 43.19 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.911 1.284 . . . . 0.0 110.935 -173.768 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -78.09 137.65 38.34 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.611 1.164 . . . . 0.0 111.188 178.291 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 51.0 mt -92.61 159.4 36.58 Favored Pre-proline 0 CA--C 1.545 0.772 0 C-N-CA 124.603 1.161 . . . . 0.0 111.823 177.437 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -64.96 -6.82 13.54 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 123.515 2.81 . . . . 0.0 113.993 173.573 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -68.43 -11.62 59.99 Favored 'General case' 0 CA--C 1.557 1.244 0 CA-C-N 119.336 0.971 . . . . 0.0 112.688 169.608 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 88.4 -34.16 3.91 Favored Glycine 0 N--CA 1.475 1.235 0 C-N-CA 126.964 2.221 . . . . 0.0 115.612 168.77 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 23.7 ptt-85 -140.5 73.61 1.43 Allowed 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 123.865 1.793 . . . . 0.0 109.925 172.008 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -169.54 137.83 1.84 Allowed 'General case' 0 C--O 1.237 0.446 0 C-N-CA 127.251 2.22 . . . . 0.0 107.195 -170.884 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 -143.86 137.97 28.3 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -167.642 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -92.28 126.07 37.2 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.432 1.093 . . . . 0.0 109.178 167.161 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 40.0 mtt -120.31 112.22 18.75 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 125.309 1.443 . . . . 0.0 108.793 -178.496 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 60.9 m -115.88 132.02 56.77 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 114.727 1.38 . . . . 0.0 114.727 -166.998 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 33.5 t -97.7 91.34 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 N-CA-C 105.777 -1.934 . . . . 0.0 105.777 166.743 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 86.0 t -73.54 121.48 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 123.764 0.825 . . . . 0.0 109.551 -178.971 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 59.39 73.88 0.46 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.007 1.723 . . . . 0.0 111.4 -175.675 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -79.97 147.86 31.41 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.372 1.469 . . . . 0.0 112.93 -175.91 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -116.48 162.75 17.1 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 126.904 2.082 . . . . 0.0 110.459 179.044 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 83.6 mtm-85 -56.18 -24.98 44.98 Favored 'General case' 0 N--CA 1.483 1.176 0 O-C-N 121.174 -0.954 . . . . 0.0 113.555 171.505 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -65.37 -25.36 67.54 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 124.816 1.246 . . . . 0.0 114.112 171.63 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -81.86 -26.69 34.01 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.924 0.89 . . . . 0.0 112.649 -179.622 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 45.4 m -48.78 133.0 17.89 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.337 1.055 . . . . 0.0 112.43 177.239 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 150.67 -162.0 29.19 Favored Glycine 0 N--CA 1.469 0.84 0 C-N-CA 123.839 0.733 . . . . 0.0 113.196 -172.784 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.9 m -96.1 140.86 30.21 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.289 1.436 . . . . 0.0 110.902 -172.706 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -134.13 156.22 48.68 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.642 1.577 . . . . 0.0 112.824 -177.159 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -155.17 156.19 35.26 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.264 1.426 . . . . 0.0 112.66 173.63 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -119.93 137.27 54.14 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.338 1.855 . . . . 0.0 109.847 176.144 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -141.74 132.44 5.25 Favored Glycine 0 N--CA 1.471 0.995 0 C-N-CA 124.086 0.851 . . . . 0.0 113.51 -171.556 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -88.52 156.18 19.23 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.025 0.93 . . . . 0.0 112.001 175.253 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 17.7 tt -154.08 133.7 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 124.889 1.276 . . . . 0.0 110.43 173.965 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 77.3 p -77.45 161.59 27.85 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.423 1.089 . . . . 0.0 113.135 178.427 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.82 -2.09 11.2 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 115.297 1.592 . . . . 0.0 115.297 178.479 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -73.03 145.74 86.56 Favored Pre-proline 0 CA--C 1.551 1.012 0 C-N-CA 124.287 1.035 . . . . 0.0 112.512 -177.101 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -56.53 -30.31 82.12 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 123.408 2.739 . . . . 0.0 113.949 172.794 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 59.7 mtpt -88.98 5.05 46.05 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.131 1.372 . . . . 0.0 114.059 -178.305 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.4 162.22 18.19 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.429 1.092 . . . . 0.0 113.848 -175.758 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -150.5 151.3 32.47 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.928 1.691 . . . . 0.0 109.185 -178.881 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 52.0 mt -68.93 122.57 20.57 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 123.685 0.794 . . . . 0.0 110.436 -177.512 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -80.83 88.4 5.84 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.91 1.284 . . . . 0.0 110.181 175.726 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -76.93 158.78 30.48 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.539 1.536 . . . . 0.0 112.879 -179.118 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 6.1 t -147.57 -170.22 3.51 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.821 0.848 . . . . 0.0 113.003 169.889 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 92.6 mt -68.93 127.77 34.29 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.984 1.714 . . . . 0.0 111.23 -177.488 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 10.7 mpt_? -68.51 159.64 31.39 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 126.236 1.814 . . . . 0.0 115.132 -168.851 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.91 169.68 9.05 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 127.256 2.222 . . . . 0.0 110.63 168.709 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -131.01 144.04 51.17 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.584 1.153 . . . . 0.0 112.334 -177.103 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 64.2 tp -112.93 137.62 51.04 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 126.374 1.87 . . . . 0.0 110.206 171.604 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 72.1 ttt180 -127.95 119.27 25.17 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.702 1.601 . . . . 0.0 109.851 169.812 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 41.5 t -100.89 118.68 47.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 124.673 1.189 . . . . 0.0 108.22 169.204 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 75.2 p -97.52 157.84 15.8 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.69 1.596 . . . . 0.0 110.785 178.955 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 56.7 mp0 -62.29 151.56 36.14 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.341 1.056 . . . . 0.0 112.332 -179.347 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 39.0 ttm105 . . . . . 0 C--O 1.236 0.365 0 C-N-CA 124.102 0.961 . . . . 0.0 110.332 -177.125 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.3 t . . . . . 0 N--CA 1.47 0.532 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 57.4 t80 -150.56 118.2 6.15 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 127.217 2.207 . . . . 0.0 109.405 -174.495 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 98.2 p -140.94 160.87 56.7 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 124.49 1.116 . . . . 0.0 113.704 -170.632 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -70.64 164.0 82.87 Favored 'Cis proline' 0 C--N 1.354 0.859 0 CA-C-N 119.91 1.003 . . . . 0.0 111.548 -6.561 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.44 -23.57 66.97 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 175.0 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 44.4 tp -142.2 122.82 14.2 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.617 1.567 . . . . 0.0 108.785 171.024 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 61.4 tp -110.68 125.83 53.88 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.086 1.354 . . . . 0.0 109.07 170.685 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 12.6 p -108.04 128.37 63.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 123.969 0.907 . . . . 0.0 109.775 169.826 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.7 m -128.78 168.22 22.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 125.096 1.359 . . . . 0.0 111.716 172.924 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 88.4 m -90.72 148.83 22.33 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.372 1.069 . . . . 0.0 110.37 171.581 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -57.14 117.03 3.63 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.989 1.716 . . . . 0.0 111.174 175.743 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.0 5.62 65.91 Favored Glycine 0 CA--C 1.532 1.136 0 C-N-CA 125.464 1.506 . . . . 0.0 114.694 -175.252 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -97.06 158.16 15.56 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 119.435 1.618 . . . . 0.0 112.324 173.22 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 29.4 m120 -72.81 131.83 42.79 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.73 1.212 . . . . 0.0 111.199 173.845 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -117.86 114.01 22.62 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.562 1.145 . . . . 0.0 111.186 178.757 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 32.8 m -124.72 125.33 43.91 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.536 0.734 . . . . 0.0 111.905 -174.273 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -101.46 158.13 16.3 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.513 1.925 . . . . 0.0 110.4 169.965 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 28.1 m -102.67 137.39 40.96 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.349 1.46 . . . . 0.0 109.597 172.684 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 39.1 t -130.28 142.76 50.53 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.068 1.347 . . . . 0.0 111.812 170.498 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.9 m -140.61 128.07 21.33 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.009 0.524 . . . . 0.0 112.285 -174.233 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 26.4 m-85 . . . . . 0 N--CA 1.472 0.653 0 C-N-CA 126.826 2.05 . . . . 0.0 113.412 175.764 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 35.1 p90 . . . . . 0 CA--C 1.54 0.584 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.3 t -95.98 125.08 48.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 N-CA-C 106.277 -1.749 . . . . 0.0 106.277 168.474 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 19.5 tp -101.94 134.84 44.5 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 123.569 0.748 . . . . 0.0 110.037 175.28 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 8.6 m-80 -132.03 145.79 51.66 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.832 1.253 . . . . 0.0 110.903 -169.773 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 11.5 t90 -111.43 140.65 45.84 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 124.596 1.158 . . . . 0.0 111.374 178.289 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -133.78 140.29 46.85 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 -175.668 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 68.3 ttt180 -96.58 140.0 31.84 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.268 1.027 . . . . 0.0 108.742 167.834 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 33.3 mtp -97.02 145.92 25.49 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -177.085 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.8 p -85.49 163.77 43.21 Favored Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 123.717 0.807 . . . . 0.0 111.355 169.258 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -67.76 -18.4 47.62 Favored 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 122.661 2.24 . . . . 0.0 112.763 172.781 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 32.7 m -83.34 1.55 40.67 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.635 1.174 . . . . 0.0 112.91 170.861 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 74.46 22.44 2.13 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 127.784 2.433 . . . . 0.0 113.759 179.424 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -83.34 177.07 8.66 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.213 0.605 . . . . 0.0 109.463 168.399 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 11.7 p -144.22 139.1 28.5 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.841 1.257 . . . . 0.0 111.098 -169.904 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -122.51 130.11 52.7 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.028 0.931 . . . . 0.0 111.5 174.679 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -73.01 126.94 31.13 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.372 0.669 . . . . 0.0 111.021 -179.258 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 43.4 mt -98.27 -46.37 5.84 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.739 1.615 . . . . 0.0 111.989 -173.698 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -167.83 167.79 12.76 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 127.167 2.187 . . . . 0.0 109.784 -174.04 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -156.75 160.2 39.05 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.392 1.077 . . . . 0.0 112.372 -176.212 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -133.76 130.67 20.79 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 124.861 1.264 . . . . 0.0 110.21 170.607 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo . . . . . 0 C--N 1.351 0.673 0 CA-C-N 119.932 1.012 . . . . 0.0 111.473 -3.928 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 12.4 mtp85 . . . . . 0 N--CA 1.466 0.339 0 N-CA-C 115.344 1.609 . . . . 0.0 115.344 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -118.3 140.47 49.78 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.137 1.775 . . . . 0.0 111.318 -174.156 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 31.4 ttp-105 -140.11 144.1 36.59 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.163 1.385 . . . . 0.0 111.465 -174.493 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 46.3 t -121.87 127.87 75.53 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 C-N-CA 124.887 1.275 . . . . 0.0 108.485 169.18 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 89.3 m -130.6 134.88 47.35 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.173 1.389 . . . . 0.0 110.403 -174.365 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 22.1 pt20 -79.92 141.66 35.86 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.574 0.749 . . . . 0.0 111.887 173.851 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 72.3 mt -93.9 158.38 36.44 Favored Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 124.904 1.282 . . . . 0.0 111.675 178.171 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -65.56 -4.72 10.13 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 123.549 2.832 . . . . 0.0 113.848 174.209 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 21.2 m120 -65.19 -18.53 65.39 Favored 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 119.15 0.886 . . . . 0.0 113.044 169.97 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 95.66 -34.14 5.07 Favored Glycine 0 N--CA 1.474 1.168 0 C-N-CA 126.457 1.98 . . . . 0.0 114.241 169.884 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 90.4 mtt-85 -141.41 73.65 1.43 Allowed 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.571 1.549 . . . . 0.0 109.173 169.308 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -164.82 144.81 7.28 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 126.787 2.035 . . . . 0.0 108.087 178.706 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -142.65 147.35 35.61 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 -168.055 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -105.19 138.63 41.08 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.163 1.385 . . . . 0.0 110.917 168.884 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 31.5 mtt -121.42 108.66 13.93 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 126.238 1.815 . . . . 0.0 107.816 179.32 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 17.5 t -122.26 128.35 51.0 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 -165.994 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 12.9 t -88.32 124.9 41.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 125.269 1.428 . . . . 0.0 107.356 168.073 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 67.4 t -84.29 112.48 21.61 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 C-N-CA 124.916 1.287 . . . . 0.0 108.887 174.535 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 80.7 mtt85 54.97 70.39 0.63 Allowed 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.714 1.605 . . . . 0.0 111.656 175.997 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.64 128.46 36.05 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.196 0.998 . . . . 0.0 111.792 -174.391 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 10.1 mpt_? -89.22 161.94 16.16 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.945 1.298 . . . . 0.0 109.828 173.557 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 71.8 mtm180 -58.73 -23.72 60.32 Favored 'General case' 0 N--CA 1.484 1.255 0 O-C-N 120.628 -1.295 . . . . 0.0 113.578 172.676 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -55.01 -26.88 40.02 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.576 1.551 . . . . 0.0 113.367 167.99 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 34.9 m-20 -95.73 -1.22 50.33 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.584 1.554 . . . . 0.0 113.207 -169.46 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 69.4 m -64.4 138.31 58.35 Favored 'General case' 0 CA--C 1.544 0.727 0 O-C-N 120.401 -1.437 . . . . 0.0 111.643 169.837 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 160.1 -167.41 35.47 Favored Glycine 0 N--CA 1.473 1.12 0 O-C-N 121.167 -0.958 . . . . 0.0 113.608 178.866 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.8 m -93.84 145.54 24.53 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.464 0.706 . . . . 0.0 110.004 175.701 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -139.56 158.99 43.19 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.85 2.06 . . . . 0.0 110.281 -178.671 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.9 pp -152.83 167.16 29.97 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.96 0.904 . . . . 0.0 112.558 171.095 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 50.4 t -114.32 144.76 42.73 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.676 1.591 . . . . 0.0 110.935 -178.767 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -147.79 139.04 7.49 Favored Glycine 0 N--CA 1.472 1.094 0 C-N-CA 124.031 0.824 . . . . 0.0 113.906 177.584 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -109.46 159.21 17.23 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.728 1.211 . . . . 0.0 112.387 179.161 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.4 tt -146.68 131.77 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 125.321 1.448 . . . . 0.0 109.355 169.377 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.3 m -67.29 152.33 45.91 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.449 1.1 . . . . 0.0 111.92 -177.905 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 3.7 pp -70.72 -11.5 60.98 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 115.372 1.619 . . . . 0.0 115.372 -170.936 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -74.32 148.03 85.77 Favored Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 123.808 0.843 . . . . 0.0 112.069 174.924 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -67.54 -18.74 48.94 Favored 'Trans proline' 0 CA--C 1.54 0.775 0 C-N-CA 123.189 2.593 . . . . 0.0 113.383 -179.015 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -76.83 -10.15 59.17 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.839 1.256 . . . . 0.0 113.718 176.433 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.25 162.32 20.29 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.931 1.292 . . . . 0.0 114.024 -175.106 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -137.92 157.96 45.33 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.109 1.764 . . . . 0.0 109.434 174.75 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 65.4 mt -72.91 132.55 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 123.386 0.674 . . . . 0.0 110.944 -177.986 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -122.34 135.29 54.69 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.772 2.029 . . . . 0.0 110.093 173.389 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -112.65 148.0 35.56 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.181 0.992 . . . . 0.0 113.524 -167.662 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 69.8 m -84.58 -175.45 5.79 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.428 1.491 . . . . 0.0 111.918 168.867 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -63.35 156.48 25.68 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.121 0.968 . . . . 0.0 110.552 168.924 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -93.84 155.45 17.19 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.17 0.988 . . . . 0.0 111.613 172.855 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -147.79 159.96 43.25 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.141 1.376 . . . . 0.0 112.291 -176.029 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -104.12 138.44 40.61 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.913 1.285 . . . . 0.0 112.046 -175.013 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 46.9 tp -109.91 126.7 54.15 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 125.998 1.719 . . . . 0.0 108.688 169.212 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 70.9 ttt180 -118.34 119.38 34.46 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.975 1.71 . . . . 0.0 109.603 175.531 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 43.8 t -104.09 120.39 54.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 C-N-CA 124.341 1.057 . . . . 0.0 108.582 170.367 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 68.1 p -98.9 150.07 22.29 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.308 1.443 . . . . 0.0 109.727 175.435 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 37.1 mp0 -50.73 150.49 2.83 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.978 1.311 . . . . 0.0 112.867 -177.971 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 57.7 ttp180 . . . . . 0 C--O 1.236 0.353 0 C-N-CA 124.449 1.099 . . . . 0.0 109.496 -178.11 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 37.2 p . . . . . 0 N--CA 1.476 0.864 0 CA-C-O 120.574 0.226 . . . . 0.0 111.067 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -121.46 134.13 55.07 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.255 1.422 . . . . 0.0 110.117 178.533 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.4 m -140.83 157.45 67.53 Favored Pre-proline 0 N--CA 1.477 0.892 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 179.918 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -70.64 157.87 94.14 Favored 'Cis proline' 0 C--N 1.351 0.662 0 CA-C-N 119.327 0.795 . . . . 0.0 110.887 -8.993 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -57.69 -32.7 67.62 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 172.146 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 50.6 tp -138.93 120.37 14.96 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.531 1.533 . . . . 0.0 109.342 170.733 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 50.6 tp -100.62 127.27 47.07 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.524 1.53 . . . . 0.0 109.24 171.146 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.7 t -111.52 124.61 68.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 124.099 0.96 . . . . 0.0 108.562 171.805 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.1 m -127.58 164.32 28.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 124.493 1.117 . . . . 0.0 111.562 173.959 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 16.8 m -88.33 151.27 22.73 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.681 1.193 . . . . 0.0 110.472 173.662 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.12 120.53 2.45 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.942 1.697 . . . . 0.0 112.563 171.634 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.18 1.08 89.64 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 125.868 1.699 . . . . 0.0 115.408 179.692 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -85.13 157.26 20.73 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 119.65 1.725 . . . . 0.0 111.914 175.744 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -82.54 123.53 29.29 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.696 0.798 . . . . 0.0 110.353 177.548 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -104.55 123.79 48.16 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.667 1.187 . . . . 0.0 110.928 -178.529 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 36.0 m -132.3 126.87 34.37 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.002 0.921 . . . . 0.0 111.516 -175.963 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -100.37 153.98 18.88 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 126.1 1.76 . . . . 0.0 110.837 171.027 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 39.4 m -101.53 128.41 47.79 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 125.266 1.426 . . . . 0.0 108.572 169.759 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 95.6 m -124.67 128.77 49.34 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.606 1.162 . . . . 0.0 109.538 170.603 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.9 m -111.0 127.85 55.66 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.744 0.818 . . . . 0.0 109.884 -173.923 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 . . . . . 0 CA--C 1.534 0.339 0 C-N-CA 124.239 1.016 . . . . 0.0 110.874 174.912 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 49.2 p90 . . . . . 0 CA--C 1.54 0.57 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 24.2 t -125.77 119.93 56.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 125.0 1.32 . . . . 0.0 107.878 168.648 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 59.0 tp -99.43 139.4 35.14 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 124.819 1.247 . . . . 0.0 108.662 169.601 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 9.7 m-80 -133.8 152.8 51.98 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.761 1.224 . . . . 0.0 111.193 -170.809 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 24.0 t90 -128.19 139.41 52.49 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.871 1.268 . . . . 0.0 111.04 175.469 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -135.31 143.41 46.16 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 114.677 1.362 . . . . 0.0 114.677 -170.404 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 55.9 ttp85 -93.14 144.46 25.26 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.913 1.685 . . . . 0.0 107.104 165.614 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 28.9 mtp -96.91 145.95 25.41 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 118.945 0.793 . . . . 0.0 112.244 172.62 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 59.3 m -102.89 158.64 31.35 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 125.029 1.331 . . . . 0.0 111.301 169.809 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_exo -56.6 -30.97 85.36 Favored 'Trans proline' 0 C--N 1.355 0.917 0 C-N-CA 124.405 3.403 . . . . 0.0 115.163 -172.97 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 14.3 m -77.02 11.86 1.62 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.001 1.32 . . . . 0.0 113.655 178.094 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 46.3 t30 69.12 25.4 5.81 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 127.164 2.186 . . . . 0.0 112.445 -176.913 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -92.72 170.51 9.66 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.203 1.001 . . . . 0.0 110.628 172.85 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 9.9 p -134.74 152.55 51.85 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.457 1.503 . . . . 0.0 111.555 -174.722 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 43.4 t0 -136.47 125.77 24.84 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.701 1.601 . . . . 0.0 110.042 -177.823 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 12.7 ttmm -75.05 126.13 30.38 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.235 0.541 . . . . 0.0 110.734 -175.875 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 91.0 mt -95.37 -49.43 5.45 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.248 1.419 . . . . 0.0 111.147 -177.8 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -160.82 176.72 11.16 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.41 1.484 . . . . 0.0 110.445 177.296 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -152.85 166.7 31.46 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.862 1.265 . . . . 0.0 112.043 -174.857 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -137.72 115.27 9.6 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 126.033 1.733 . . . . 0.0 109.117 172.587 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo . . . . . 0 C--N 1.352 0.715 0 CA-C-N 120.289 1.139 . . . . 0.0 113.935 -5.803 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 . . . . . 0 N--CA 1.472 0.625 0 N-CA-C 114.271 1.212 . . . . 0.0 114.271 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -101.91 127.23 48.84 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.916 1.286 . . . . 0.0 110.118 176.498 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -134.2 143.12 47.67 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.412 1.085 . . . . 0.0 112.197 -171.133 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 26.0 t -126.56 127.7 70.54 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 125.14 1.376 . . . . 0.0 109.232 168.562 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 90.3 m -130.52 137.38 49.7 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.479 1.512 . . . . 0.0 110.779 -174.286 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 65.4 tt0 -86.02 134.73 33.83 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.119 0.968 . . . . 0.0 110.59 172.188 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 65.8 mt -87.13 158.92 52.07 Favored Pre-proline 0 CA--C 1.542 0.635 0 C-N-CA 124.203 1.001 . . . . 0.0 112.064 -179.281 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -63.97 -6.97 12.15 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 123.645 2.897 . . . . 0.0 114.017 173.8 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -64.58 -26.04 68.23 Favored 'General case' 0 CA--C 1.552 1.022 0 CA-C-N 119.559 1.072 . . . . 0.0 112.191 169.094 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 92.98 -34.04 4.75 Favored Glycine 0 CA--C 1.53 1.018 0 C-N-CA 126.556 2.027 . . . . 0.0 113.591 174.637 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 22.9 ptt180 -130.75 73.54 1.55 Allowed 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 122.835 1.302 . . . . 0.0 110.378 171.003 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -175.47 143.94 0.66 Allowed 'General case' 0 C--O 1.237 0.398 0 C-N-CA 127.393 2.277 . . . . 0.0 109.14 -177.663 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -142.51 148.31 37.43 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -168.782 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 10.0 m170 -107.31 134.88 49.73 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.26 1.424 . . . . 0.0 111.621 170.442 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -119.92 121.36 38.84 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 126.192 1.797 . . . . 0.0 107.923 178.002 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 22.7 t -133.78 137.04 44.93 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 116.285 1.958 . . . . 0.0 116.285 -166.721 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 48.4 t -96.58 116.26 38.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 C-N-CA 126.906 2.083 . . . . 0.0 107.318 168.265 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 88.5 t -76.83 127.29 37.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 123.657 0.783 . . . . 0.0 109.026 169.599 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 54.4 ttt85 54.75 71.33 0.54 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.931 1.693 . . . . 0.0 111.551 176.864 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -69.83 129.42 39.51 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.627 0.771 . . . . 0.0 110.98 -177.535 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 37.7 mmm-85 -103.74 161.91 13.53 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 126.019 1.727 . . . . 0.0 110.268 179.492 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 3.2 mmm180 -51.81 -34.28 39.37 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 121.009 -1.057 . . . . 0.0 113.418 -179.628 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -66.89 -19.49 65.74 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.408 1.483 . . . . 0.0 115.001 176.81 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -75.9 -13.7 60.26 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 119.831 1.196 . . . . 0.0 113.144 177.992 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.2 m -62.83 129.16 39.23 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 120.661 -1.275 . . . . 0.0 112.156 179.998 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 161.3 -166.46 35.84 Favored Glycine 0 CA--C 1.529 0.924 0 C-N-CA 124.111 0.863 . . . . 0.0 113.246 -173.583 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.6 m -96.83 144.28 26.94 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.664 1.186 . . . . 0.0 110.833 -177.244 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -143.03 158.29 43.74 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.363 1.865 . . . . 0.0 111.321 -175.553 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.2 pp -158.64 166.53 31.84 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.555 1.142 . . . . 0.0 112.208 174.295 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 71.3 m -113.61 162.12 16.6 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.889 1.275 . . . . 0.0 111.268 177.384 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -156.72 133.89 3.81 Favored Glycine 0 N--CA 1.471 0.977 0 O-C-N 121.529 -0.732 . . . . 0.0 114.12 176.462 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -114.52 147.85 38.79 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.285 1.034 . . . . 0.0 112.685 -178.451 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 16.9 tt -153.96 147.97 13.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.296 1.438 . . . . 0.0 111.035 -179.389 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 66.1 m -77.63 150.73 34.58 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 120.918 -1.114 . . . . 0.0 110.689 169.493 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.86 -4.9 37.72 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 115.413 1.635 . . . . 0.0 115.413 -174.333 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -75.05 147.18 83.3 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 124.68 1.192 . . . . 0.0 111.894 174.134 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -68.77 -17.14 42.31 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 123.434 2.756 . . . . 0.0 113.77 -176.613 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -73.66 -16.14 61.22 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.532 1.133 . . . . 0.0 113.575 176.268 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -71.67 168.1 18.43 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.137 1.375 . . . . 0.0 113.765 -176.052 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.54 149.06 35.24 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.125 1.77 . . . . 0.0 108.664 176.866 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 34.0 mt -75.48 121.61 27.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 123.893 0.877 . . . . 0.0 110.928 -175.123 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 36.6 tptt -81.81 115.31 20.97 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.683 0.793 . . . . 0.0 109.769 168.985 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -108.91 158.87 17.28 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.723 2.009 . . . . 0.0 110.587 174.226 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 5.6 t -143.96 -168.03 2.75 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.369 1.068 . . . . 0.0 112.156 176.384 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 98.7 mt -60.82 117.5 5.48 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.874 1.669 . . . . 0.0 111.884 -172.478 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 20.2 ptp180 -66.32 157.86 30.61 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.656 1.582 . . . . 0.0 113.632 -174.67 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -122.36 165.75 15.79 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 127.038 2.135 . . . . 0.0 111.52 -175.057 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -128.01 143.13 51.07 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.585 1.154 . . . . 0.0 111.885 -177.657 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 56.4 tp -113.27 135.94 53.29 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 126.196 1.798 . . . . 0.0 109.97 172.563 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -126.66 123.23 37.1 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.81 1.644 . . . . 0.0 109.539 169.726 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 46.5 t -103.01 124.35 57.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 107.143 -1.429 . . . . 0.0 107.143 169.275 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 67.5 p -101.3 155.3 18.12 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.313 1.445 . . . . 0.0 110.904 177.25 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -58.75 150.81 22.65 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.752 0.787 . . . . 0.0 112.845 178.645 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.466 0.349 0 C-N-CA 124.323 1.049 . . . . 0.0 109.049 -179.471 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 85.5 m . . . . . 0 N--CA 1.476 0.863 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -145.08 114.45 7.11 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.152 1.781 . . . . 0.0 109.755 172.793 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 69.2 m -140.91 160.06 59.81 Favored Pre-proline 0 N--CA 1.479 0.976 0 C-N-CA 124.762 1.225 . . . . 0.0 113.069 -170.895 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -71.21 158.71 94.9 Favored 'Cis proline' 0 C--N 1.353 0.788 0 CA-C-N 120.152 1.09 . . . . 0.0 111.531 -4.261 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.55 -25.21 64.35 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 175.387 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 45.2 tp -142.45 122.55 13.73 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.445 1.498 . . . . 0.0 109.044 169.988 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 61.6 tp -108.74 125.47 51.96 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.21 1.404 . . . . 0.0 108.881 169.75 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 12.8 p -108.79 129.33 63.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 123.877 0.871 . . . . 0.0 109.653 169.629 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 28.5 m -130.23 163.09 36.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 124.952 1.301 . . . . 0.0 111.42 173.07 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 16.3 m -84.77 147.47 26.84 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.079 0.951 . . . . 0.0 109.963 170.223 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 64.7 tt0 -56.43 124.95 19.91 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 124.931 1.292 . . . . 0.0 110.696 173.524 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.91 -2.78 84.47 Favored Glycine 0 CA--C 1.532 1.139 0 C-N-CA 126.085 1.802 . . . . 0.0 114.781 -174.795 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -87.58 160.99 17.98 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 119.35 1.575 . . . . 0.0 111.748 172.263 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -87.05 121.44 29.51 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.328 1.051 . . . . 0.0 110.495 177.331 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -97.61 128.49 44.37 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.393 1.077 . . . . 0.0 110.601 177.481 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 97.0 m -132.68 127.05 33.97 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 119.336 0.971 . . . . 0.0 111.84 176.125 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -100.99 159.48 15.17 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.609 1.964 . . . . 0.0 110.409 169.302 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 59.1 m -103.8 134.28 47.38 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.144 1.378 . . . . 0.0 109.312 171.451 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 3.3 t -137.15 142.27 42.22 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.579 1.152 . . . . 0.0 112.366 177.943 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 90.5 p -147.05 154.18 40.87 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 121.065 -1.022 . . . . 0.0 113.115 -176.877 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 . . . . . 0 N--CA 1.469 0.499 0 C-N-CA 126.429 1.892 . . . . 0.0 112.34 -172.467 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 55.6 p90 . . . . . 0 CA--C 1.539 0.524 0 CA-C-O 120.996 0.426 . . . . 0.0 112.134 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 48.8 t -95.98 127.86 47.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 125.154 1.381 . . . . 0.0 107.274 169.909 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.0 tt -99.37 119.75 38.47 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 173.277 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 23.2 m-80 -112.79 149.41 33.07 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.14 1.376 . . . . 0.0 111.146 179.349 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 11.5 t90 -119.25 142.1 48.34 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.72 1.208 . . . . 0.0 111.7 175.807 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -137.15 149.12 47.07 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.705 1.202 . . . . 0.0 113.769 -169.976 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 79.0 ttt-85 -108.04 140.28 41.44 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.397 1.479 . . . . 0.0 108.252 167.348 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 29.0 mtp -84.41 145.91 27.94 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.59 0.632 . . . . 0.0 112.35 178.345 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 66.0 m -107.64 153.2 41.57 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 125.266 1.426 . . . . 0.0 112.026 179.912 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -56.0 -30.03 76.34 Favored 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 124.69 3.593 . . . . 0.0 115.202 -177.286 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.3 m -76.98 10.16 2.49 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.843 1.257 . . . . 0.0 113.491 178.844 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 67.96 44.85 1.44 Allowed 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.825 2.05 . . . . 0.0 110.585 -175.223 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -124.09 -172.69 2.59 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.518 1.527 . . . . 0.0 109.946 177.892 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.2 p -146.01 148.13 32.38 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.719 1.608 . . . . 0.0 110.403 -174.333 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -124.69 132.59 53.39 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 124.126 0.97 . . . . 0.0 111.258 173.196 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 29.9 ttmt -76.2 126.0 30.19 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.684 1.193 . . . . 0.0 110.766 -179.41 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 66.3 mt -101.54 -51.98 3.33 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 125.501 1.52 . . . . 0.0 111.75 -170.412 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -160.46 160.86 32.6 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 127.009 2.123 . . . . 0.0 108.767 -171.963 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.57 165.4 32.95 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.65 0.78 . . . . 0.0 111.867 -174.936 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -138.19 115.61 9.31 Favored Pre-proline 0 CA--C 1.545 0.763 0 C-N-CA 124.678 1.191 . . . . 0.0 110.749 171.105 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo . . . . . 0 C--N 1.352 0.724 0 CA-C-N 119.253 0.769 . . . . 0.0 110.941 -11.659 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 48.6 mtm180 . . . . . 0 N--CA 1.472 0.627 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 80.3 m-85 -69.81 125.78 27.75 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.01 1.324 . . . . 0.0 111.24 173.025 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 8.2 tmm_? -144.47 139.9 28.59 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.55 1.54 . . . . 0.0 111.915 -169.623 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 65.2 t -119.31 133.46 66.06 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 C-N-CA 125.122 1.369 . . . . 0.0 110.378 172.462 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 45.2 m -127.16 134.42 50.18 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 125.509 1.523 . . . . 0.0 110.473 177.767 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -84.08 138.04 33.26 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.743 1.217 . . . . 0.0 111.022 175.459 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 45.6 mt -93.73 159.19 35.24 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 124.828 1.251 . . . . 0.0 111.695 177.768 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -65.56 -4.47 9.67 Favored 'Trans proline' 0 CA--C 1.542 0.92 0 C-N-CA 123.538 2.825 . . . . 0.0 114.293 174.976 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -68.23 -13.11 62.0 Favored 'General case' 0 CA--C 1.553 1.058 0 CA-C-N 119.454 1.025 . . . . 0.0 112.948 169.825 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 93.84 -34.12 4.83 Favored Glycine 0 N--CA 1.475 1.272 0 C-N-CA 126.66 2.076 . . . . 0.0 114.889 169.327 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 31.0 ptt-85 -146.12 73.63 1.34 Allowed 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 123.967 1.842 . . . . 0.0 110.138 169.792 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -161.58 141.03 10.12 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 128.872 2.869 . . . . 0.0 106.232 -176.349 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -146.09 148.5 32.7 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 -166.696 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 -100.08 122.33 42.78 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.182 1.393 . . . . 0.0 110.135 168.462 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -105.74 105.81 16.02 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 126.653 1.981 . . . . 0.0 108.291 179.975 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.2 m -114.69 145.6 41.85 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -168.704 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 11.0 t -116.82 106.41 20.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 126.588 1.955 . . . . 0.0 106.37 167.313 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 79.4 t -68.61 127.22 30.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 174.069 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 57.4 ttm-85 53.87 68.14 0.89 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.1 1.36 . . . . 0.0 111.457 170.74 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -70.76 138.21 50.28 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.0 0.92 . . . . 0.0 112.118 -173.883 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 8.7 mpt_? -107.67 158.63 17.11 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 126.028 1.731 . . . . 0.0 109.743 175.211 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 40.1 mtp180 -56.15 -32.27 64.13 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 -172.245 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 5.0 p-10 -64.67 -18.68 65.19 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 114.998 1.481 . . . . 0.0 114.998 175.955 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -71.62 -24.78 61.94 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.085 0.857 . . . . 0.0 112.317 177.169 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 19.3 m -54.71 141.55 31.86 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.254 1.022 . . . . 0.0 112.746 -178.37 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 146.98 -163.77 28.61 Favored Glycine 0 N--CA 1.471 1.029 0 C-N-CA 124.432 1.015 . . . . 0.0 113.083 -174.414 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.3 m -92.0 141.04 29.05 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.406 1.082 . . . . 0.0 110.599 -178.308 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 33.6 m-85 -132.57 159.63 38.92 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.779 2.032 . . . . 0.0 110.942 178.818 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -166.25 155.84 11.76 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.61 1.564 . . . . 0.0 112.033 179.909 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 30.8 m -99.53 159.93 14.66 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.873 0.869 . . . . 0.0 112.036 172.86 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -148.06 122.12 1.47 Allowed Glycine 0 CA--C 1.525 0.713 0 C-N-CA 124.836 1.208 . . . . 0.0 111.954 169.668 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -91.55 156.77 17.43 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.592 0.757 . . . . 0.0 111.437 173.886 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.1 tt -152.99 133.05 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 124.453 1.101 . . . . 0.0 110.526 176.654 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 8.5 m -65.42 161.47 19.78 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.739 1.216 . . . . 0.0 113.464 -175.079 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -60.51 -21.78 62.85 Favored 'General case' 0 CA--C 1.547 0.827 0 N-CA-C 115.573 1.694 . . . . 0.0 115.573 -179.258 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -78.33 143.5 64.69 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 124.318 1.047 . . . . 0.0 112.702 -174.755 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -57.35 -25.6 66.41 Favored 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 123.556 2.837 . . . . 0.0 114.514 173.349 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -81.63 -0.79 44.08 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 125.058 1.343 . . . . 0.0 113.811 179.723 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.43 167.6 10.37 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.917 1.287 . . . . 0.0 114.164 -176.242 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -143.06 153.75 43.26 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 126.508 1.923 . . . . 0.0 108.811 179.717 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 99.1 mt -71.64 123.62 26.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 CA-C-O 121.583 0.706 . . . . 0.0 111.98 -174.793 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.92 99.13 11.91 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.801 1.64 . . . . 0.0 106.83 167.326 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -84.6 137.89 33.03 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.323 0.649 . . . . 0.0 111.187 -171.497 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 8.1 t -94.89 -175.43 3.56 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.537 1.135 . . . . 0.0 113.098 179.613 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 9.8 mp -60.94 149.7 35.64 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.347 1.859 . . . . 0.0 111.285 178.788 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -92.76 141.87 27.97 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.384 1.074 . . . . 0.0 109.808 172.155 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -147.26 164.16 34.08 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.755 1.222 . . . . 0.0 111.839 175.875 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -109.44 139.86 43.9 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.217 1.007 . . . . 0.0 112.671 -170.492 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 64.1 tp -108.48 132.15 54.1 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 125.915 1.686 . . . . 0.0 108.963 168.614 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 62.5 ttm-85 -123.83 115.92 22.11 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.754 1.622 . . . . 0.0 109.702 174.028 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 48.7 t -102.78 113.81 40.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 124.372 1.069 . . . . 0.0 108.75 172.006 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 65.0 p -93.65 146.83 23.54 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.605 1.562 . . . . 0.0 109.885 177.95 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -62.79 148.7 46.08 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 121.413 -0.804 . . . . 0.0 112.91 -175.782 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 45.8 ttt85 . . . . . 0 N--CA 1.467 0.383 0 C-N-CA 124.047 0.939 . . . . 0.0 110.257 -173.943 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.8 p . . . . . 0 N--CA 1.473 0.688 0 CA-C-O 121.465 0.65 . . . . 0.0 112.125 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -146.33 120.22 9.33 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.912 1.685 . . . . 0.0 109.159 -178.159 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 80.5 p -140.97 159.37 62.25 Favored Pre-proline 0 CA--C 1.55 0.947 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -169.872 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -69.59 161.46 85.63 Favored 'Cis proline' 0 C--N 1.354 0.833 0 CA-C-N 119.551 0.875 . . . . 0.0 111.501 -6.434 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.48 -24.65 67.91 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 113.169 0.803 . . . . 0.0 113.169 176.052 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 46.7 tp -140.4 120.77 14.01 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.568 1.547 . . . . 0.0 108.761 169.854 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 55.4 tp -105.96 125.79 51.42 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.267 1.427 . . . . 0.0 109.029 170.635 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.4 t -110.27 124.39 66.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 124.082 0.953 . . . . 0.0 108.563 173.041 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.6 m -128.3 164.71 29.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 C-N-CA 124.644 1.178 . . . . 0.0 111.635 174.421 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 18.3 m -90.83 148.8 22.27 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.707 1.203 . . . . 0.0 110.437 173.962 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -53.18 123.68 12.45 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.823 1.249 . . . . 0.0 111.406 176.428 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 89.12 -1.56 82.92 Favored Glycine 0 CA--C 1.533 1.199 0 C-N-CA 125.869 1.7 . . . . 0.0 114.826 -177.298 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -86.72 156.68 19.86 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 119.597 1.698 . . . . 0.0 111.877 173.217 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -83.88 123.68 30.18 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.856 0.862 . . . . 0.0 110.294 175.682 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -101.48 129.15 47.48 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.478 1.111 . . . . 0.0 110.894 179.182 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 65.3 m -132.77 126.61 32.8 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.895 0.878 . . . . 0.0 111.533 -178.573 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -101.68 152.12 21.21 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.729 1.612 . . . . 0.0 110.812 169.747 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.6 m -100.72 126.77 47.29 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.639 1.576 . . . . 0.0 109.236 175.853 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 49.4 t -117.97 138.5 52.13 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.382 1.873 . . . . 0.0 111.124 177.561 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 74.1 m -137.55 126.93 24.82 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.528 -0.733 . . . . 0.0 110.17 176.054 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 . . . . . 0 CA--C 1.534 0.329 0 C-N-CA 125.707 1.603 . . . . 0.0 113.978 175.838 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 46.1 p90 . . . . . 0 CA--C 1.538 0.489 0 CA-C-O 121.012 0.434 . . . . 0.0 112.075 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 93.8 t -95.9 125.36 48.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 125.119 1.368 . . . . 0.0 107.332 169.378 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 56.8 tp -99.95 136.94 39.11 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.978 0.911 . . . . 0.0 110.29 178.059 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 -127.25 160.29 31.74 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.397 1.479 . . . . 0.0 110.627 -176.58 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 19.0 t90 -126.38 139.79 53.0 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.075 1.35 . . . . 0.0 111.427 179.606 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -136.13 144.52 45.11 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.763 1.225 . . . . 0.0 113.749 -171.82 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 56.8 ttt85 -102.49 140.15 37.14 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.886 1.674 . . . . 0.0 107.789 167.162 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 35.4 mtp -89.64 145.94 24.89 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 118.98 0.809 . . . . 0.0 112.318 176.235 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.1 p -89.16 162.06 38.61 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 123.824 0.849 . . . . 0.0 111.991 172.141 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -67.79 -18.87 47.52 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 122.755 2.303 . . . . 0.0 112.642 172.413 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.6 m -80.8 3.99 20.58 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 124.744 1.218 . . . . 0.0 113.042 170.83 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 63.7 t30 70.97 26.38 3.6 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 127.329 2.252 . . . . 0.0 113.24 178.5 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -96.71 -172.7 2.54 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.408 1.083 . . . . 0.0 109.755 169.705 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.0 p -141.6 145.16 34.71 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.619 1.567 . . . . 0.0 110.698 -174.372 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -124.72 130.58 52.69 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 125.035 1.334 . . . . 0.0 110.776 175.821 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 37.5 tttm -83.77 119.1 24.4 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.61 1.164 . . . . 0.0 111.66 -173.134 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 57.5 mt -93.55 -49.19 6.01 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.559 1.544 . . . . 0.0 112.446 -169.278 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -166.5 176.38 7.39 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.289 1.836 . . . . 0.0 110.546 -173.798 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -158.48 163.47 37.1 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.721 1.209 . . . . 0.0 112.674 -175.142 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -137.62 122.72 12.49 Favored Pre-proline 0 CA--C 1.549 0.904 0 C-N-CA 125.569 1.548 . . . . 0.0 109.802 169.977 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo . . . . . 0 C--N 1.352 0.726 0 CA-C-N 120.056 1.056 . . . . 0.0 111.745 -4.251 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 1.7 ptm85 . . . . . 0 N--CA 1.471 0.592 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -101.01 126.25 47.67 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.196 1.398 . . . . 0.0 110.267 179.065 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 79.3 mtm180 -134.25 149.81 50.98 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.705 1.202 . . . . 0.0 111.858 -178.24 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 46.6 t -126.5 130.98 71.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 125.112 1.365 . . . . 0.0 109.334 171.11 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 92.4 m -130.53 132.73 45.74 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.687 1.195 . . . . 0.0 110.233 -179.48 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -80.58 141.74 34.76 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.37 0.668 . . . . 0.0 111.824 173.548 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 26.4 mt -90.36 158.29 43.65 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 124.03 0.932 . . . . 0.0 111.342 173.604 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -66.73 -4.69 11.58 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 123.61 2.873 . . . . 0.0 113.97 174.814 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 23.7 m120 -64.31 -18.99 65.13 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.167 0.987 . . . . 0.0 113.428 172.439 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 95.18 -20.92 46.95 Favored Glycine 0 N--CA 1.474 1.205 0 C-N-CA 125.77 1.652 . . . . 0.0 115.392 169.715 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -154.5 73.53 0.91 Allowed 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.468 1.507 . . . . 0.0 109.914 171.288 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -170.39 136.97 1.39 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 127.707 2.403 . . . . 0.0 107.662 -171.99 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 70.8 m-85 -145.18 145.81 31.5 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.891 0.877 . . . . 0.0 112.916 -168.192 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -101.76 125.83 48.5 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.236 1.415 . . . . 0.0 111.433 169.998 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -104.91 112.96 26.28 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.819 2.048 . . . . 0.0 108.419 174.884 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 67.6 m -122.03 129.18 52.22 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 115.147 1.536 . . . . 0.0 115.147 -167.954 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 44.3 t -96.36 116.49 38.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 125.916 1.687 . . . . 0.0 107.532 168.288 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 85.7 t -78.63 125.84 38.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 124.158 0.983 . . . . 0.0 110.177 176.412 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 51.11 66.71 1.1 Allowed 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 126.218 1.807 . . . . 0.0 112.157 175.456 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.42 130.48 43.19 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.508 1.123 . . . . 0.0 111.572 -173.352 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.03 169.58 8.59 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.952 1.701 . . . . 0.0 110.274 171.706 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 27.7 mtp180 -56.29 -30.71 62.86 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 121.208 -0.932 . . . . 0.0 113.373 -177.098 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 29.7 t30 -60.43 -27.94 67.88 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 124.967 1.307 . . . . 0.0 114.387 172.299 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -75.62 -14.54 60.38 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.289 0.95 . . . . 0.0 113.086 175.536 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 34.2 m -61.63 141.34 57.86 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 120.231 1.378 . . . . 0.0 111.65 177.385 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 150.41 -169.67 30.34 Favored Glycine 0 N--CA 1.473 1.138 0 C-N-CA 124.377 0.989 . . . . 0.0 113.345 -176.997 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.3 m -94.88 142.45 27.45 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.271 1.028 . . . . 0.0 110.517 -178.057 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -138.82 162.51 34.58 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.137 1.775 . . . . 0.0 111.71 -179.144 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -161.75 157.56 24.46 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.578 1.551 . . . . 0.0 111.783 174.183 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 25.9 p -104.68 151.73 23.35 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.456 0.702 . . . . 0.0 111.754 168.834 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -148.47 133.05 4.41 Favored Glycine 0 N--CA 1.471 0.986 0 C-N-CA 124.709 1.147 . . . . 0.0 112.784 -177.836 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -110.57 156.02 21.51 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -176.175 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 19.7 tt -137.89 136.13 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 125.698 1.599 . . . . 0.0 109.921 174.026 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 14.4 t -62.77 157.52 20.97 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.774 0.83 . . . . 0.0 112.953 176.935 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.49 -9.65 50.31 Favored 'General case' 0 CA--C 1.546 0.827 0 N-CA-C 114.274 1.213 . . . . 0.0 114.274 169.95 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -68.56 149.18 98.07 Favored Pre-proline 0 CA--C 1.553 1.078 0 C-N-CA 124.341 1.056 . . . . 0.0 112.428 178.592 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -69.32 -26.13 29.93 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 122.951 2.434 . . . . 0.0 112.812 178.853 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.8 ptmt -86.04 5.22 34.51 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.218 1.407 . . . . 0.0 114.581 178.055 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.41 163.17 18.87 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.799 1.24 . . . . 0.0 114.214 -173.335 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.96 157.25 43.42 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 126.308 1.843 . . . . 0.0 108.648 176.875 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 61.7 mt -78.31 124.38 36.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 123.861 0.865 . . . . 0.0 111.269 -174.482 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 24.1 tptp -94.55 126.93 40.15 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.297 1.439 . . . . 0.0 109.613 168.839 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -84.38 157.02 21.57 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.293 1.037 . . . . 0.0 112.059 175.237 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 97.0 p -108.33 -166.13 1.1 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 125.241 1.416 . . . . 0.0 111.099 168.128 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 11.1 mp -63.16 151.02 41.41 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.347 1.059 . . . . 0.0 111.715 172.661 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -90.69 142.74 27.45 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.075 0.95 . . . . 0.0 109.985 171.542 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -135.0 152.93 52.18 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 125.322 1.449 . . . . 0.0 111.809 178.74 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -104.51 138.87 40.24 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.661 1.184 . . . . 0.0 111.687 -177.9 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 50.9 tp -108.81 129.28 55.39 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 125.905 1.682 . . . . 0.0 109.202 169.348 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 60.6 ttt85 -121.69 120.22 34.07 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.795 1.638 . . . . 0.0 109.71 173.664 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 39.1 t -104.22 118.91 52.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 124.177 0.991 . . . . 0.0 109.045 171.626 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 67.4 p -98.74 154.77 17.74 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 126.114 1.766 . . . . 0.0 110.459 178.266 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -65.85 144.78 56.61 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.674 -0.641 . . . . 0.0 112.21 -177.367 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 35.9 ttt85 . . . . . 0 N--CA 1.467 0.411 0 C-N-CA 124.577 1.151 . . . . 0.0 109.862 179.169 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.7 t . . . . . 0 N--CA 1.47 0.565 0 N-CA-C 112.802 0.668 . . . . 0.0 112.802 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 82.9 t80 -149.05 117.46 6.49 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.593 2.357 . . . . 0.0 108.647 -176.603 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 91.8 p -140.96 159.35 62.36 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 124.554 1.142 . . . . 0.0 113.558 -169.032 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -70.35 164.98 79.55 Favored 'Cis proline' 0 C--N 1.355 0.893 0 CA-C-N 119.987 1.031 . . . . 0.0 112.221 -2.535 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.05 -24.94 68.15 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 175.573 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 40.2 tp -143.55 119.03 10.32 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 125.772 1.629 . . . . 0.0 108.855 169.847 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 56.6 tp -102.1 124.39 47.63 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.656 1.182 . . . . 0.0 108.859 169.536 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.8 t -110.17 124.51 66.98 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 172.756 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 30.5 m -126.06 163.56 27.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 C-N-CA 124.388 1.075 . . . . 0.0 111.781 172.398 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 35.1 m -92.53 144.95 24.83 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.031 0.932 . . . . 0.0 109.863 171.836 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -49.65 124.59 9.86 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.333 1.453 . . . . 0.0 112.579 -179.262 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 91.52 -3.89 79.26 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 126.052 1.787 . . . . 0.0 114.818 -177.415 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -84.75 157.64 20.97 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.585 1.692 . . . . 0.0 112.088 174.929 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -83.61 117.65 23.3 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.84 0.856 . . . . 0.0 110.478 175.64 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -97.83 114.46 26.51 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.152 0.981 . . . . 0.0 111.134 -177.3 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 30.5 m -117.56 126.5 52.68 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.758 0.823 . . . . 0.0 111.793 -177.164 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -100.89 159.51 15.14 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.527 1.931 . . . . 0.0 109.969 169.385 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 93.3 m -102.36 139.16 38.33 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.346 1.458 . . . . 0.0 108.699 169.669 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 46.8 t -130.35 146.33 51.92 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.707 1.203 . . . . 0.0 111.234 171.062 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 16.0 t -149.54 133.62 17.18 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 121.347 -0.846 . . . . 0.0 111.342 179.044 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 18.5 m-85 . . . . . 0 N--CA 1.467 0.41 0 C-N-CA 127.779 2.432 . . . . 0.0 111.69 -179.103 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 44.9 p90 . . . . . 0 CA--C 1.543 0.678 0 N-CA-C 111.437 0.162 . . . . 0.0 111.437 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 22.4 t -96.0 128.04 47.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 171.05 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 18.8 tp -105.12 139.11 40.28 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.911 0.884 . . . . 0.0 110.072 171.726 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 14.8 m-80 -132.94 150.38 52.16 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.582 1.553 . . . . 0.0 110.644 -169.698 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 9.4 t90 -121.71 137.55 54.71 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.201 1.0 . . . . 0.0 111.758 -178.493 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -134.07 144.32 48.56 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.565 1.146 . . . . 0.0 113.155 -175.434 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -104.89 140.08 38.68 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.028 1.331 . . . . 0.0 108.438 168.251 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 27.2 mtp -87.12 141.82 28.38 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 118.717 0.69 . . . . 0.0 111.956 178.879 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 50.2 m -92.81 157.98 38.64 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 124.888 1.275 . . . . 0.0 111.919 176.562 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_exo -55.73 -33.8 88.82 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 123.919 3.079 . . . . 0.0 114.113 176.48 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.7 m -77.03 9.55 2.91 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.182 1.393 . . . . 0.0 113.768 176.932 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 26.8 m120 70.42 20.9 5.85 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 127.336 2.254 . . . . 0.0 113.359 -179.016 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -89.99 -173.73 3.98 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.482 1.113 . . . . 0.0 110.549 170.555 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.9 p -144.15 145.93 32.43 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.779 1.632 . . . . 0.0 110.507 -175.635 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -123.15 132.4 54.06 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.648 1.179 . . . . 0.0 111.192 175.243 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -79.01 126.87 31.26 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.921 0.888 . . . . 0.0 111.382 -177.892 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 59.4 mt -99.75 -45.15 5.84 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.984 1.313 . . . . 0.0 112.472 -169.968 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -173.99 175.9 2.69 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.713 2.405 . . . . 0.0 110.282 -174.102 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.55 168.83 25.19 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.206 1.403 . . . . 0.0 112.379 -178.544 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -144.66 122.29 6.53 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 125.64 1.576 . . . . 0.0 110.042 169.481 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo . . . . . 0 C--N 1.352 0.759 0 CA-C-N 120.435 1.191 . . . . 0.0 112.582 -9.319 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 44.5 mtp-105 . . . . . 0 N--CA 1.474 0.774 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -92.03 127.88 37.67 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.922 1.289 . . . . 0.0 109.736 175.625 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -131.15 144.16 51.17 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.19 1.396 . . . . 0.0 110.804 -175.867 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 47.8 t -126.57 128.28 71.05 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 124.846 1.258 . . . . 0.0 108.986 176.478 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 88.5 m -125.98 132.31 52.07 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.82 1.248 . . . . 0.0 110.287 -176.939 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -88.13 137.94 31.88 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.024 0.929 . . . . 0.0 110.407 172.735 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 44.2 mt -87.47 158.7 51.31 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 124.745 1.218 . . . . 0.0 111.433 177.669 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -65.42 -2.71 6.46 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 123.529 2.819 . . . . 0.0 114.293 175.85 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -63.52 -26.08 68.54 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 119.643 1.11 . . . . 0.0 112.861 169.735 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 98.61 -22.22 42.05 Favored Glycine 0 N--CA 1.476 1.308 0 C-N-CA 125.696 1.617 . . . . 0.0 114.273 174.579 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -154.48 73.65 0.92 Allowed 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.519 1.528 . . . . 0.0 110.166 169.381 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 17.9 t0 -163.56 141.48 7.6 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 128.919 2.888 . . . . 0.0 106.819 178.486 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -146.42 155.75 42.8 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 -167.188 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 56.7 m170 -116.15 147.61 41.19 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 126.043 1.737 . . . . 0.0 110.955 168.502 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 33.3 mtt -132.94 112.96 12.3 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.622 1.569 . . . . 0.0 109.381 -178.009 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 68.0 m -118.41 126.21 51.59 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 -167.561 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 19.7 t -90.53 108.35 19.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 167.653 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 88.7 t -70.55 125.74 29.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 123.727 0.811 . . . . 0.0 109.389 176.325 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 39.2 ttm180 54.64 63.83 2.01 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.108 1.363 . . . . 0.0 111.035 172.241 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -70.38 137.36 50.44 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.554 0.742 . . . . 0.0 111.476 -171.427 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -114.66 163.44 15.44 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.818 1.647 . . . . 0.0 110.62 -179.542 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 88.1 mtm-85 -52.88 -34.96 57.08 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.867 0.867 . . . . 0.0 112.858 -175.501 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 39.5 t30 -66.13 -16.42 63.94 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.857 1.663 . . . . 0.0 115.238 176.216 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -80.28 -14.1 58.66 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 120.305 1.411 . . . . 0.0 112.989 176.312 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 20.2 m -62.74 138.79 58.6 Favored 'General case' 0 CA--C 1.546 0.806 0 O-C-N 121.015 -1.053 . . . . 0.0 112.706 -177.543 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 150.74 -163.87 29.77 Favored Glycine 0 N--CA 1.472 1.059 0 C-N-CA 124.505 1.05 . . . . 0.0 113.293 -177.762 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.8 m -92.53 138.89 31.12 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.484 1.114 . . . . 0.0 111.277 -177.213 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -134.24 160.43 37.89 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.43 1.892 . . . . 0.0 111.395 178.218 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -157.24 158.13 35.59 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.864 1.266 . . . . 0.0 112.64 173.096 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 45.5 t -109.41 147.61 32.51 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.865 1.666 . . . . 0.0 111.033 -178.68 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -150.66 142.13 9.32 Favored Glycine 0 N--CA 1.471 0.997 0 N-CA-C 114.63 0.612 . . . . 0.0 114.63 179.272 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -115.82 159.25 21.73 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.14 1.376 . . . . 0.0 113.684 -173.933 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 19.9 tt -155.95 136.36 4.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 125.723 1.609 . . . . 0.0 110.568 173.848 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 18.2 m -65.81 161.31 21.25 Favored 'General case' 0 N--CA 1.475 0.787 0 O-C-N 121.282 -0.886 . . . . 0.0 113.115 179.927 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 56.6 mt -70.06 -20.6 63.22 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.731 1.012 . . . . 0.0 113.731 -177.882 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -70.37 146.09 93.87 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 124.35 1.06 . . . . 0.0 112.253 177.4 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -69.65 -16.6 38.1 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 123.296 2.664 . . . . 0.0 113.273 -179.653 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 47.5 mmtm -79.95 -0.27 34.44 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.78 1.232 . . . . 0.0 114.142 177.114 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -77.05 165.22 24.91 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 125.633 1.573 . . . . 0.0 113.78 -178.093 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 27.4 mp0 -138.59 155.83 48.0 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.902 1.681 . . . . 0.0 109.719 174.262 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 32.0 mm -60.48 137.11 23.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 124.421 1.088 . . . . 0.0 111.158 177.879 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.12 137.2 54.91 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.983 1.713 . . . . 0.0 109.54 169.585 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -113.94 153.7 28.83 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.27 1.028 . . . . 0.0 112.863 -169.424 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 80.2 p -104.44 173.31 6.36 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.655 1.582 . . . . 0.0 112.914 174.717 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.83 122.81 18.51 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.532 1.133 . . . . 0.0 110.88 174.416 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.73 151.26 45.59 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.14 0.976 . . . . 0.0 113.227 179.662 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -143.0 164.81 29.06 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.52 1.528 . . . . 0.0 112.913 -178.486 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -102.78 143.13 32.81 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.267 1.427 . . . . 0.0 112.834 -172.737 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 60.7 tp -114.79 132.13 56.57 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 126.343 1.857 . . . . 0.0 108.542 168.075 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 61.9 ttm-85 -126.01 120.22 29.72 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.284 1.433 . . . . 0.0 109.908 174.098 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 41.2 t -104.36 113.09 40.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 124.355 1.062 . . . . 0.0 108.623 170.507 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 71.2 p -93.01 145.31 24.47 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.342 1.457 . . . . 0.0 109.858 178.925 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -66.64 144.91 56.11 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 121.431 0.634 . . . . 0.0 111.959 -178.212 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 55.8 ttm-85 . . . . . 0 N--CA 1.467 0.384 0 C-N-CA 123.878 0.871 . . . . 0.0 110.337 -176.622 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 27.5 m . . . . . 0 N--CA 1.471 0.6 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 43.9 t80 -149.01 121.39 8.45 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.677 1.191 . . . . 0.0 110.484 -176.576 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 58.7 m -140.87 159.89 60.53 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 124.489 1.115 . . . . 0.0 113.026 -169.344 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -70.02 158.85 91.37 Favored 'Cis proline' 0 C--N 1.353 0.807 0 CA-C-N 119.88 0.993 . . . . 0.0 111.482 -5.168 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.56 -30.99 69.02 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 174.476 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 33.4 tp -134.93 123.08 22.83 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 125.44 1.496 . . . . 0.0 108.932 170.403 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 54.7 tp -108.37 124.84 50.99 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.736 1.214 . . . . 0.0 109.256 170.524 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 18.8 t -109.76 124.31 66.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 C-N-CA 123.935 0.894 . . . . 0.0 108.898 173.566 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.6 m -127.64 169.83 18.43 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 C-N-CA 124.897 1.279 . . . . 0.0 111.355 171.924 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 89.5 m -100.0 147.86 25.15 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.771 1.229 . . . . 0.0 110.244 174.757 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -55.32 119.1 5.06 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.676 1.19 . . . . 0.0 112.159 179.808 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.87 -1.16 63.16 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 126.301 1.905 . . . . 0.0 114.709 -176.911 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -90.93 153.73 19.98 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 119.275 1.538 . . . . 0.0 110.924 171.245 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -80.79 139.91 35.77 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 121.875 0.845 . . . . 0.0 111.519 171.919 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -114.65 130.27 56.78 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.246 1.818 . . . . 0.0 110.545 -178.664 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 30.9 m -132.7 124.6 28.49 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.71 0.804 . . . . 0.0 111.618 -176.552 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -101.59 159.57 15.19 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.032 1.733 . . . . 0.0 110.299 169.469 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 25.9 m -112.66 132.02 55.37 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.368 1.467 . . . . 0.0 110.067 175.057 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 35.3 t -114.39 140.82 48.36 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.572 1.549 . . . . 0.0 112.08 171.899 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 17.2 m -134.13 131.85 39.19 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.967 1.707 . . . . 0.0 108.305 176.036 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 42.4 p90 . . . . . 0 N--CA 1.474 0.772 0 CA-C-N 119.919 1.236 . . . . 0.0 113.558 -169.179 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 55.9 p90 . . . . . 0 CA--C 1.537 0.458 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 62.4 t -107.14 124.2 62.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 125.5 1.52 . . . . 0.0 107.08 167.681 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -99.4 140.78 33.07 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.454 1.502 . . . . 0.0 108.014 170.701 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 31.4 m120 -136.68 149.42 47.91 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.502 1.521 . . . . 0.0 111.171 175.331 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 22.0 t90 -124.55 138.36 54.33 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.525 1.13 . . . . 0.0 110.73 174.602 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -132.47 147.94 52.38 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 -170.939 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.9 ttt180 -109.26 141.34 41.69 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.792 1.637 . . . . 0.0 108.355 167.242 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 36.2 mtp -86.42 145.89 26.66 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 118.944 0.793 . . . . 0.0 112.462 176.301 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.1 p -88.88 165.2 28.34 Favored Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 123.89 0.876 . . . . 0.0 112.662 174.162 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -58.82 -28.98 88.65 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 123.636 2.891 . . . . 0.0 113.433 170.594 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.4 m -80.36 1.78 27.49 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.896 1.279 . . . . 0.0 113.265 175.939 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 73.61 21.09 2.92 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 127.588 2.355 . . . . 0.0 113.213 -179.649 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -88.38 -172.67 3.87 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.622 0.769 . . . . 0.0 109.575 169.483 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.3 p -140.59 142.86 35.04 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.376 1.47 . . . . 0.0 110.804 -174.84 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -122.86 131.53 53.79 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.505 1.122 . . . . 0.0 110.922 175.442 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 20.8 ttmt -71.9 137.74 47.65 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.873 0.869 . . . . 0.0 110.632 178.385 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 52.8 mt -114.61 -45.99 2.98 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.936 1.695 . . . . 0.0 111.975 -171.944 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -156.51 168.62 26.82 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 126.281 1.832 . . . . 0.0 109.689 179.683 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -156.62 163.68 39.05 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.348 1.059 . . . . 0.0 111.955 -174.801 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -149.2 110.35 3.46 Favored Pre-proline 0 CA--C 1.547 0.835 0 CA-C-O 118.024 -0.988 . . . . 0.0 110.676 174.646 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo . . . . . 0 C--N 1.352 0.734 0 CA-C-N 120.64 1.264 . . . . 0.0 113.623 -4.794 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 44.6 mtp180 . . . . . 0 N--CA 1.472 0.66 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 -95.01 137.48 34.0 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.937 1.295 . . . . 0.0 111.079 178.43 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 30.0 ttp180 -144.46 151.61 39.43 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.234 1.014 . . . . 0.0 111.925 177.421 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -122.79 133.83 67.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 124.962 1.305 . . . . 0.0 110.753 168.869 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.1 m -130.5 130.01 43.63 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.098 1.359 . . . . 0.0 109.871 -173.247 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -79.4 136.38 36.95 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 118.736 0.698 . . . . 0.0 110.778 178.549 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 7.0 mt -79.79 159.9 70.39 Favored Pre-proline 0 CA--C 1.544 0.715 0 CA-C-O 118.92 -0.562 . . . . 0.0 111.652 177.773 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -62.85 -16.74 55.65 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 123.135 2.556 . . . . 0.0 113.646 170.996 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -66.11 -26.06 67.28 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 119.231 0.923 . . . . 0.0 112.439 169.793 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 86.21 -34.11 3.49 Favored Glycine 0 N--CA 1.472 1.066 0 C-N-CA 126.836 2.16 . . . . 0.0 114.393 169.881 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 -111.53 73.65 0.83 Allowed 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.594 1.158 . . . . 0.0 108.194 169.41 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 175.36 141.3 0.05 Allowed 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 128.388 2.675 . . . . 0.0 109.739 -170.606 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -142.33 150.22 40.48 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.453 1.101 . . . . 0.0 112.37 178.931 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 18.2 m170 -98.82 139.24 34.79 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.329 1.452 . . . . 0.0 110.229 167.003 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -115.11 113.07 23.52 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 126.761 2.024 . . . . 0.0 108.058 175.961 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 17.8 m -118.76 128.44 54.49 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 114.331 1.234 . . . . 0.0 114.331 -167.338 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 36.6 t -99.24 117.56 44.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 125.869 1.668 . . . . 0.0 106.947 167.528 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 97.2 t -83.09 126.33 40.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 123.893 0.877 . . . . 0.0 109.96 174.577 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 85.5 mtt85 54.21 66.55 1.2 Allowed 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 126.11 1.764 . . . . 0.0 111.624 176.963 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.96 136.43 53.92 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.487 1.115 . . . . 0.0 111.308 -176.87 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -118.26 165.64 13.57 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 126.9 2.08 . . . . 0.0 110.462 -178.262 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 26.3 mmm180 -52.52 -28.73 21.83 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.348 1.059 . . . . 0.0 113.054 178.231 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -63.66 -24.22 67.7 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 125.66 1.584 . . . . 0.0 114.825 173.228 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -86.08 -17.88 33.9 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 120.147 1.34 . . . . 0.0 113.682 -176.992 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 49.3 m -57.71 133.86 55.72 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 120.779 -1.2 . . . . 0.0 112.681 -178.742 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 153.39 -167.46 31.91 Favored Glycine 0 N--CA 1.473 1.152 0 C-N-CA 124.253 0.93 . . . . 0.0 113.788 -176.073 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.2 m -91.1 143.05 27.1 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 125.162 1.385 . . . . 0.0 110.825 -175.861 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -139.94 157.55 45.5 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 126.462 1.905 . . . . 0.0 111.551 -177.796 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -156.94 149.31 23.18 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.324 1.05 . . . . 0.0 113.269 173.011 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 44.3 t -89.63 152.98 21.1 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.35 1.86 . . . . 0.0 110.884 172.057 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -160.05 141.63 7.6 Favored Glycine 0 N--CA 1.47 0.936 0 O-C-N 121.469 -0.769 . . . . 0.0 113.207 170.214 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -138.13 158.59 44.01 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 118.259 1.029 . . . . 0.0 113.154 -177.419 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 16.7 tt -147.27 134.62 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 C-N-CA 125.364 1.466 . . . . 0.0 110.097 -178.951 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 65.7 m -76.17 158.48 31.65 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 121.62 -0.675 . . . . 0.0 111.795 176.994 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 28.3 mt -73.92 -10.01 59.22 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 -177.264 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.81 143.06 94.53 Favored Pre-proline 0 CA--C 1.551 1.012 0 C-N-CA 124.104 0.962 . . . . 0.0 111.816 173.738 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -67.72 -19.83 47.05 Favored 'Trans proline' 0 CA--C 1.538 0.675 0 C-N-CA 123.313 2.676 . . . . 0.0 113.35 -176.943 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 23.3 ttpp -83.7 -0.39 50.56 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 124.92 1.288 . . . . 0.0 113.572 177.459 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -74.87 149.75 39.43 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.364 1.066 . . . . 0.0 113.39 -178.277 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -128.89 158.29 39.19 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.925 2.09 . . . . 0.0 107.764 169.991 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 35.1 mt -70.94 114.9 9.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 O-C-N 121.487 -0.758 . . . . 0.0 110.43 -179.072 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -77.85 88.51 4.06 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.32 1.448 . . . . 0.0 108.792 169.629 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -78.65 133.71 37.21 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.129 0.972 . . . . 0.0 110.394 176.898 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 45.0 m -83.68 175.53 9.64 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.396 1.078 . . . . 0.0 113.225 179.669 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 84.5 mt -58.56 147.49 32.03 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.188 0.995 . . . . 0.0 111.563 171.682 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -75.51 132.29 40.65 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 123.369 0.668 . . . . 0.0 110.561 173.839 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.9 169.65 9.07 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 126.268 1.827 . . . . 0.0 109.877 170.06 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -133.98 145.09 49.19 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 122.027 0.917 . . . . 0.0 113.021 173.271 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 68.0 tp -103.66 135.11 45.85 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 127.081 2.152 . . . . 0.0 109.687 176.233 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 60.7 ttt85 -125.27 118.09 25.22 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.731 1.612 . . . . 0.0 109.858 172.425 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 53.2 t -98.4 118.81 45.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 C-N-CA 124.062 0.945 . . . . 0.0 108.573 169.057 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 81.7 p -91.53 149.81 21.5 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.411 1.485 . . . . 0.0 109.999 173.438 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -63.16 147.09 51.87 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.276 0.56 . . . . 0.0 112.035 -179.028 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 27.5 ttm180 . . . . . 0 C--O 1.237 0.402 0 C-N-CA 123.805 0.842 . . . . 0.0 109.93 -176.072 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 32.1 p . . . . . 0 N--CA 1.479 1.008 0 CA-C-O 120.119 0.009 . . . . 0.0 110.994 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.408 ' CE1' ' HB2' ' A' ' 123' ' ' CYS . 3.9 m-85 -121.86 135.67 54.9 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.004 1.322 . . . . 0.0 110.557 175.328 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 95.1 p -140.98 159.04 63.48 Favored Pre-proline 0 CA--C 1.549 0.921 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 173.31 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -72.7 163.72 88.0 Favored 'Cis proline' 0 C--N 1.352 0.737 0 CA-C-N 119.186 0.745 . . . . 0.0 111.411 -11.376 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.7 -33.9 74.82 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 170.432 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 51.7 tp -138.93 123.57 18.53 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.594 1.557 . . . . 0.0 109.269 171.563 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 51.6 tp -105.14 130.78 53.23 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.259 1.424 . . . . 0.0 109.341 170.755 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.4 t -112.06 126.55 69.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.987 0.915 . . . . 0.0 108.658 170.607 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.3 m -129.56 165.98 28.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 124.545 1.138 . . . . 0.0 111.933 173.079 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 20.0 m -86.3 146.5 26.48 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.178 0.991 . . . . 0.0 110.138 169.573 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 58.1 tt0 -55.32 123.59 14.3 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.042 1.337 . . . . 0.0 110.799 173.02 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.0 -0.5 72.77 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 125.5 1.524 . . . . 0.0 114.861 -174.334 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -95.43 158.08 15.61 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 119.644 1.722 . . . . 0.0 112.274 174.522 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 -83.11 116.58 22.39 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.073 0.949 . . . . 0.0 110.747 -179.866 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -98.47 116.12 30.01 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.292 1.037 . . . . 0.0 111.147 -179.793 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 57.1 m -125.28 125.45 43.55 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 118.718 0.69 . . . . 0.0 111.896 -174.609 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -101.06 146.72 27.07 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 126.371 1.868 . . . . 0.0 110.689 171.989 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 31.5 m -93.95 129.34 40.45 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.042 1.337 . . . . 0.0 108.813 171.199 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 69.8 m -130.3 130.24 44.25 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.398 1.079 . . . . 0.0 110.654 172.252 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 68.5 m -117.44 143.4 46.05 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.339 1.456 . . . . 0.0 110.687 -176.316 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 . . . . . 0 N--CA 1.468 0.446 0 C-N-CA 125.248 1.419 . . . . 0.0 113.475 -172.841 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 50.3 p90 . . . . . 0 CA--C 1.54 0.559 0 CA-C-O 120.477 0.179 . . . . 0.0 111.461 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 77.4 t -95.93 127.98 47.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 172.263 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 61.3 tp -106.54 136.16 46.79 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 125.217 1.407 . . . . 0.0 109.751 173.618 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -132.43 153.8 50.48 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.282 1.833 . . . . 0.0 110.528 179.151 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 15.0 t90 -123.52 139.82 53.63 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.659 1.184 . . . . 0.0 111.118 176.081 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 64.4 m-85 -134.28 143.7 47.91 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 114.516 1.302 . . . . 0.0 114.516 -170.824 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 56.9 ttt85 -102.19 143.01 32.53 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.575 1.55 . . . . 0.0 109.229 168.406 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 86.3 mmm -77.46 133.04 38.71 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 118.466 0.575 . . . . 0.0 111.463 174.319 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.5 p -82.45 166.22 37.73 Favored Pre-proline 0 CA--C 1.549 0.914 0 O-C-N 121.557 -0.715 . . . . 0.0 112.555 173.669 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -58.32 -27.99 83.08 Favored 'Trans proline' 0 C--N 1.354 0.856 0 C-N-CA 123.475 2.784 . . . . 0.0 113.662 170.267 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 31.3 m -83.92 2.94 36.21 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.985 1.314 . . . . 0.0 113.189 175.424 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 69.55 26.68 5.02 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 126.721 2.008 . . . . 0.0 112.639 -178.758 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -92.23 -177.47 4.67 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.083 0.953 . . . . 0.0 109.743 169.606 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 8.7 p -127.48 122.51 33.64 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.574 1.55 . . . . 0.0 109.582 -171.981 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -108.22 126.35 52.7 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 124.288 1.035 . . . . 0.0 110.976 -178.094 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -79.22 120.53 23.84 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.632 1.173 . . . . 0.0 111.98 -170.809 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 42.4 mt -97.88 -49.38 4.82 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.654 1.582 . . . . 0.0 111.991 -170.139 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -162.56 169.17 20.68 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.438 1.895 . . . . 0.0 110.145 -173.12 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -157.22 162.65 39.27 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.451 1.101 . . . . 0.0 112.928 -170.155 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -152.32 113.5 2.85 Favored Pre-proline 0 CA--C 1.552 1.038 0 C-N-CA 125.379 1.472 . . . . 0.0 111.114 174.547 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo . . . . . 0 CA--C 1.538 0.686 0 CA-C-N 119.653 0.912 . . . . 0.0 110.287 -12.041 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 60.6 mtm-85 . . . . . 0 N--CA 1.471 0.608 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 84.4 m-85 -69.48 130.68 43.16 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.473 1.509 . . . . 0.0 112.026 -179.045 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 31.8 ttp-105 -144.39 141.29 29.57 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 126.041 1.737 . . . . 0.0 111.079 -176.841 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 57.9 t -108.46 127.81 64.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 C-N-CA 125.089 1.356 . . . . 0.0 108.678 169.502 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 6.0 m -123.32 138.65 54.57 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.633 1.573 . . . . 0.0 109.428 -176.323 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.16 141.79 34.44 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.108 0.963 . . . . 0.0 112.679 179.373 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.449 HD23 ' HA ' ' A' ' 106' ' ' PHE . 0.9 OUTLIER -96.76 158.72 33.08 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 126.079 1.752 . . . . 0.0 111.169 -174.75 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -66.98 -11.28 31.64 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 123.627 2.884 . . . . 0.0 114.224 -178.993 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -66.56 -18.25 65.26 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 119.197 0.908 . . . . 0.0 113.248 172.203 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 88.83 -14.69 59.57 Favored Glycine 0 CA--C 1.535 1.3 0 C-N-CA 125.496 1.522 . . . . 0.0 115.323 175.492 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.4 ptp180 -154.51 73.53 0.91 Allowed 'General case' 0 N--CA 1.473 0.694 0 CA-C-O 122.972 1.367 . . . . 0.0 110.581 171.585 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -165.04 143.87 6.59 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 129.254 3.022 . . . . 0.0 106.684 -179.657 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . 0.449 ' HA ' HD23 ' A' ' 100' ' ' LEU . 52.0 m-85 -145.32 145.2 31.13 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -167.54 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 7.3 m-70 -109.1 117.6 34.58 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.539 1.536 . . . . 0.0 110.859 170.118 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -100.47 111.16 23.38 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 125.768 1.627 . . . . 0.0 108.206 177.855 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 13.6 t -120.12 130.09 54.46 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 -168.061 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 12.1 t -97.45 100.25 10.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 125.696 1.598 . . . . 0.0 107.045 168.444 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 95.4 t -66.83 130.8 32.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 123.662 0.785 . . . . 0.0 109.907 178.191 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . 0.265 14.6 ptm180 39.7 61.16 1.48 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 127.516 2.326 . . . . 0.0 113.94 -177.123 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.76 140.01 57.71 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.403 1.481 . . . . 0.0 112.605 -171.731 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -104.61 162.02 13.63 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.355 1.462 . . . . 0.0 110.866 -179.478 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 16.4 mmm180 -47.48 -41.12 20.0 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.471 1.108 . . . . 0.0 113.015 178.043 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -65.27 -21.56 66.74 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 125.349 1.46 . . . . 0.0 114.832 177.657 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -75.8 -12.24 60.13 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 119.133 0.879 . . . . 0.0 112.532 176.993 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.5 m -59.09 139.53 56.78 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 120.634 -1.291 . . . . 0.0 111.609 171.794 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 154.76 -168.28 32.79 Favored Glycine 0 N--CA 1.468 0.771 0 C-N-CA 123.927 0.775 . . . . 0.0 113.313 179.428 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.1 m -95.5 144.23 26.16 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.934 1.294 . . . . 0.0 110.191 -179.115 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 -142.82 162.95 34.11 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.605 1.562 . . . . 0.0 112.488 -175.143 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.1 pp -153.48 148.39 26.57 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.845 1.258 . . . . 0.0 111.984 169.154 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . 0.408 ' HB2' ' CE1' ' A' ' 37' ' ' PHE . 71.0 m -90.24 153.1 20.74 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.701 1.2 . . . . 0.0 109.652 169.383 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -152.95 134.1 4.31 Favored Glycine 0 N--CA 1.471 1.026 0 O-C-N 121.225 -0.922 . . . . 0.0 113.373 176.45 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -119.75 157.57 28.32 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.347 1.059 . . . . 0.0 112.417 -178.856 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.0 tt -151.41 132.17 4.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 124.868 1.267 . . . . 0.0 110.77 177.939 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 44.9 t -65.21 157.82 27.81 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.894 0.877 . . . . 0.0 112.819 178.251 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 3.8 pp -71.51 -9.48 58.27 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 175.024 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -66.5 146.09 99.02 Favored Pre-proline 0 CA--C 1.552 1.023 0 C-N-CA 124.318 1.047 . . . . 0.0 112.057 175.948 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -68.75 -24.6 34.49 Favored 'Trans proline' 0 CA--C 1.539 0.736 0 C-N-CA 123.092 2.528 . . . . 0.0 113.023 -178.746 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.6 ptmt -83.16 1.37 40.87 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 177.827 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.04 163.75 21.66 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.525 1.13 . . . . 0.0 113.751 -174.837 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 22.3 pt20 -149.68 163.07 38.94 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.53 1.932 . . . . 0.0 109.31 175.32 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 67.1 mt -73.13 119.27 19.74 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 CA-C-O 121.799 0.809 . . . . 0.0 111.174 -173.65 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 25.2 ttmt -88.08 124.73 34.07 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 126.857 2.063 . . . . 0.0 109.536 169.688 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -147.72 158.72 44.15 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.266 1.426 . . . . 0.0 111.292 -179.036 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 17.9 m -117.46 -173.54 2.44 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.674 1.59 . . . . 0.0 111.913 179.855 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 98.5 mt -60.02 143.25 52.33 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.125 0.97 . . . . 0.0 111.836 176.533 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 91.8 mtm-85 -66.52 153.35 43.17 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.91 1.284 . . . . 0.0 113.388 -172.619 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.89 162.56 17.15 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.567 1.947 . . . . 0.0 110.811 175.675 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -130.16 142.74 50.56 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.604 1.162 . . . . 0.0 111.618 -177.2 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 50.9 tp -116.09 133.89 55.54 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 125.978 1.711 . . . . 0.0 110.082 173.41 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 43.5 ttm180 -122.36 117.17 25.41 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.881 1.673 . . . . 0.0 109.31 170.427 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 54.4 t -99.99 119.21 47.74 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 N-CA-C 107.861 -1.162 . . . . 0.0 107.861 169.962 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 72.6 p -98.68 139.9 33.7 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.31 1.444 . . . . 0.0 109.422 177.614 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 4.5 pm0 -62.98 146.04 54.02 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.672 0.789 . . . . 0.0 113.119 -173.041 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 42.9 ttt85 . . . . . 0 C--O 1.235 0.341 0 C-N-CA 124.132 0.973 . . . . 0.0 110.338 -170.179 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.8 t . . . . . 0 N--CA 1.473 0.719 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -146.82 118.0 7.81 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.642 1.977 . . . . 0.0 110.007 179.332 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 90.2 p -140.91 163.23 43.92 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 125.027 1.331 . . . . 0.0 113.5 -171.114 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -70.87 165.5 79.6 Favored 'Cis proline' 0 C--N 1.353 0.803 0 CA-C-N 119.932 1.011 . . . . 0.0 111.818 -7.945 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.64 -29.52 70.74 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 172.785 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 51.8 tp -141.31 124.63 16.55 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.65 1.58 . . . . 0.0 109.205 172.356 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 61.3 tp -109.53 126.02 53.12 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.489 1.516 . . . . 0.0 109.012 170.685 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.2 t -110.25 125.14 67.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 123.921 0.888 . . . . 0.0 108.784 173.359 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 33.5 m -130.39 162.8 37.62 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.075 0 C-N-CA 124.667 1.187 . . . . 0.0 112.091 174.053 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 16.5 m -88.36 147.48 24.73 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.533 1.133 . . . . 0.0 110.478 171.874 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -58.61 121.56 11.3 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.884 0.874 . . . . 0.0 112.117 -179.514 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 98.98 -2.94 58.34 Favored Glycine 0 CA--C 1.533 1.162 0 C-N-CA 125.844 1.688 . . . . 0.0 114.54 -173.903 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -87.65 158.16 18.92 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 119.743 1.772 . . . . 0.0 112.443 177.314 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -77.48 116.04 17.74 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.429 1.092 . . . . 0.0 110.492 170.633 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -102.63 119.62 39.14 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.993 0.917 . . . . 0.0 110.439 178.528 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 54.1 m -128.84 125.37 37.56 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 119.052 0.842 . . . . 0.0 111.711 -175.996 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -98.09 155.69 17.01 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.068 1.747 . . . . 0.0 110.253 169.826 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 56.5 m -107.97 125.7 51.83 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.094 1.358 . . . . 0.0 109.476 177.344 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 16.6 t -118.37 151.64 37.36 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.825 1.25 . . . . 0.0 111.265 170.458 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 24.8 t -147.94 133.28 18.53 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.161 -0.962 . . . . 0.0 111.76 174.186 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 33.2 m-85 . . . . . 0 N--CA 1.468 0.457 0 C-N-CA 127.699 2.399 . . . . 0.0 110.083 170.369 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 24.3 p90 . . . . . 0 CA--C 1.536 0.433 0 N-CA-C 113.959 1.096 . . . . 0.0 113.959 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 57.3 t -106.37 135.5 44.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 C-N-CA 126.432 1.893 . . . . 0.0 107.662 169.595 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 20.9 tp -104.57 135.96 45.01 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.639 0.775 . . . . 0.0 110.59 171.656 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -127.92 156.06 43.21 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.293 1.437 . . . . 0.0 111.577 -170.035 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 16.2 t90 -129.39 136.03 49.45 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.778 1.231 . . . . 0.0 111.69 -179.607 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -135.84 145.89 46.9 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.399 1.08 . . . . 0.0 112.815 -176.726 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.8 ttt-85 -103.39 141.78 35.36 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.328 1.451 . . . . 0.0 108.85 168.883 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 31.5 mtp -90.29 145.36 25.04 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 118.747 0.703 . . . . 0.0 112.113 178.15 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 70.8 m -95.81 154.86 38.96 Favored Pre-proline 0 CA--C 1.546 0.82 0 C-N-CA 125.175 1.39 . . . . 0.0 111.182 173.526 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -65.44 -23.4 58.2 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 123.175 2.584 . . . . 0.0 113.088 179.435 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 14.6 m -76.96 9.38 2.97 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.087 1.355 . . . . 0.0 113.534 172.398 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . 0.323 0.0 OUTLIER 70.95 20.84 5.19 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 128.891 2.876 . . . . 0.0 114.555 179.545 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -93.66 -174.31 3.43 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.766 1.226 . . . . 0.0 110.949 170.605 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.5 p -144.15 152.56 41.07 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 126.382 1.873 . . . . 0.0 110.317 -175.546 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -128.68 133.15 48.12 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.436 1.094 . . . . 0.0 111.083 172.937 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -78.07 128.3 33.63 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.834 0.854 . . . . 0.0 111.173 -179.95 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 61.4 mt -100.25 -51.02 3.77 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.819 1.248 . . . . 0.0 111.414 -170.342 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -171.09 173.33 5.07 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.582 1.953 . . . . 0.0 110.483 -176.663 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -158.63 161.64 37.2 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.3 1.44 . . . . 0.0 112.077 -176.977 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -141.23 125.5 10.38 Favored Pre-proline 0 CA--C 1.548 0.889 0 C-N-CA 125.148 1.379 . . . . 0.0 110.192 172.549 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo . . . . . 0 C--N 1.351 0.661 0 CA-C-N 120.257 1.128 . . . . 0.0 113.144 -9.025 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 8.8 ptp180 . . . . . 0 N--CA 1.469 0.496 0 N-CA-C 113.666 0.988 . . . . 0.0 113.666 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -93.35 135.62 34.39 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.165 0.986 . . . . 0.0 111.634 -179.349 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 52.6 mtm180 -139.96 153.12 46.82 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.776 1.23 . . . . 0.0 112.255 177.937 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 63.6 t -126.5 125.55 67.48 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 125.265 1.426 . . . . 0.0 108.094 168.139 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 87.2 m -130.43 126.62 37.46 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.249 1.02 . . . . 0.0 110.235 -178.414 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -80.89 139.87 35.66 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.654 0.781 . . . . 0.0 110.748 174.369 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 16.3 mt -80.85 158.46 70.44 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 124.078 0.951 . . . . 0.0 111.585 177.117 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -65.08 -4.21 8.6 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 123.429 2.752 . . . . 0.0 114.99 179.142 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -70.59 -25.97 63.3 Favored 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 120.562 1.528 . . . . 0.0 112.467 169.908 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 96.58 -3.94 63.6 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 126.214 1.864 . . . . 0.0 114.628 173.701 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 31.2 ptt180 -154.62 73.71 0.91 Allowed 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.937 1.695 . . . . 0.0 110.501 176.17 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -178.02 143.02 0.3 Allowed 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 128.951 2.9 . . . . 0.0 107.905 179.389 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -146.46 136.83 23.82 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.489 0.661 . . . . 0.0 112.757 -168.693 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -98.73 125.55 44.08 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.257 1.423 . . . . 0.0 111.615 170.066 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -104.23 103.24 12.98 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 127.172 2.189 . . . . 0.0 108.39 175.184 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 54.5 p -117.12 132.63 56.62 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 114.842 1.423 . . . . 0.0 114.842 -169.491 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 12.3 t -96.36 111.31 26.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 126.109 1.763 . . . . 0.0 106.961 167.312 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 94.3 t -78.38 127.94 38.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 124.785 1.234 . . . . 0.0 109.302 175.061 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 13.8 tpt180 57.79 54.53 6.14 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.874 1.27 . . . . 0.0 111.092 174.882 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.47 136.85 58.1 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.226 -0.921 . . . . 0.0 113.171 -168.723 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 45.4 mmm-85 -111.38 160.53 16.98 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 125.553 1.541 . . . . 0.0 111.021 -179.248 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 77.3 mtm180 -55.84 -22.59 25.8 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 113.515 0.932 . . . . 0.0 113.515 172.323 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -56.72 -35.51 68.64 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.754 1.621 . . . . 0.0 113.654 168.322 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -83.89 -23.3 31.31 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.862 0.865 . . . . 0.0 112.99 -168.595 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 48.8 m -49.69 139.29 13.03 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.789 1.236 . . . . 0.0 113.119 177.417 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 148.13 -165.87 28.96 Favored Glycine 0 N--CA 1.472 1.033 0 C-N-CA 124.326 0.965 . . . . 0.0 113.359 -176.287 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.2 m -92.35 142.69 27.17 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.982 1.313 . . . . 0.0 110.533 -178.093 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 45.1 m-85 -135.5 161.16 36.27 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.848 1.659 . . . . 0.0 111.91 -179.299 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -148.95 153.28 37.74 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.747 1.219 . . . . 0.0 112.245 172.927 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 49.6 t -101.32 155.4 18.06 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.648 1.579 . . . . 0.0 110.221 169.85 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -163.29 133.6 3.11 Favored Glycine 0 N--CA 1.471 0.999 0 N-CA-C 115.345 0.898 . . . . 0.0 115.345 174.587 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -94.97 157.3 15.96 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.47 1.108 . . . . 0.0 112.76 179.793 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 18.9 tt -152.59 135.41 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 125.065 1.346 . . . . 0.0 110.184 174.673 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 69.7 p -75.53 161.57 29.06 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.68 0.792 . . . . 0.0 113.002 178.2 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.51 -3.39 8.49 Favored 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 115.51 1.67 . . . . 0.0 115.51 178.709 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -73.84 144.18 82.4 Favored Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 124.468 1.107 . . . . 0.0 112.652 -176.306 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -56.53 -32.86 91.14 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 123.362 2.708 . . . . 0.0 113.754 172.502 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.09 4.34 34.61 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 115.046 1.499 . . . . 0.0 115.046 -179.604 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.31 160.32 24.78 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.324 1.05 . . . . 0.0 113.789 -173.833 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -145.34 162.82 36.32 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.821 1.649 . . . . 0.0 110.124 175.017 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 57.8 mt -80.68 119.2 29.78 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 123.62 0.768 . . . . 0.0 111.429 -169.973 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -82.37 93.33 7.16 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.398 1.479 . . . . 0.0 108.303 168.605 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 60.2 mt-10 -79.37 144.49 34.12 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.652 0.781 . . . . 0.0 112.743 -174.658 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 50.2 m -87.37 169.28 12.4 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.814 1.245 . . . . 0.0 113.277 169.776 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 94.2 mt -65.65 150.62 48.16 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.574 0.75 . . . . 0.0 109.888 168.003 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? -76.77 148.23 36.79 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.42 0.688 . . . . 0.0 112.373 -172.531 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -117.95 166.35 12.61 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.429 1.891 . . . . 0.0 110.596 170.093 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -126.36 139.02 53.61 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.656 1.182 . . . . 0.0 111.061 176.84 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 63.7 tp -106.8 131.37 53.99 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.45 1.5 . . . . 0.0 109.531 169.82 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -121.7 109.54 14.85 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.322 1.449 . . . . 0.0 109.199 170.302 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 24.1 t -95.95 114.36 32.48 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 169.979 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 68.9 p -95.73 146.14 24.75 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.452 1.501 . . . . 0.0 109.612 -179.787 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -63.15 148.34 48.26 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 121.627 0.727 . . . . 0.0 112.539 -175.968 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 34.2 ttm180 . . . . . 0 C--O 1.235 0.34 0 C-N-CA 124.156 0.982 . . . . 0.0 110.02 -175.551 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . 0.49 ' N ' ' HG ' ' A' ' 57' ' ' SER 0.251 66.9 ttp . . . . . 0 N--CA 1.488 1.431 0 CA-C-O 116.594 -1.67 . . . . 0.0 112.595 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -73.36 148.56 43.53 Favored 'Trans proline' 0 CA--C 1.543 0.973 0 CA-C-N 122.548 1.946 . . . . 0.0 112.159 -176.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -74.25 115.08 4.2 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 123.814 3.009 . . . . 0.0 109.333 173.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 48.4 m -121.46 150.63 41.27 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.046 1.338 . . . . 0.0 110.063 -169.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -147.0 119.71 8.59 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.894 1.677 . . . . 0.0 109.385 178.026 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 88.3 p -140.85 159.13 63.47 Favored Pre-proline 0 CA--C 1.548 0.904 0 N-CA-C 113.831 1.048 . . . . 0.0 113.831 -168.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -70.06 160.75 88.38 Favored 'Cis proline' 0 C--N 1.355 0.893 0 CA-C-N 119.33 0.796 . . . . 0.0 111.513 -5.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.38 -20.52 66.42 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 176.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 36.5 tp -141.45 116.89 10.18 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 125.43 1.492 . . . . 0.0 108.819 169.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 61.2 tp -104.71 121.81 44.37 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.282 1.433 . . . . 0.0 108.856 170.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 24.0 t -110.67 122.08 64.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 124.251 1.02 . . . . 0.0 108.311 174.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 27.8 m -133.01 167.67 26.1 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 C-N-CA 124.849 1.26 . . . . 0.0 111.777 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.3 m -93.7 150.97 19.97 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.0 1.32 . . . . 0.0 110.66 174.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -46.5 125.67 7.24 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.71 1.204 . . . . 0.0 111.703 168.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.96 -1.11 82.93 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 125.906 1.717 . . . . 0.0 114.813 -179.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -74.67 151.82 39.22 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 119.801 1.801 . . . . 0.0 112.65 173.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 68.0 m-20 -86.64 88.19 7.61 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.2 1.0 . . . . 0.0 109.188 171.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -77.08 114.42 15.86 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.723 0.809 . . . . 0.0 112.351 -167.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 53.0 m -116.27 130.58 56.85 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -171.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -108.57 159.6 16.58 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 127.056 2.142 . . . . 0.0 110.027 168.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 87.9 m -112.97 126.34 55.38 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.375 1.07 . . . . 0.0 110.542 175.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 29.9 m -98.31 148.88 23.2 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.152 0.981 . . . . 0.0 110.215 167.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 39.3 t -139.06 127.4 22.81 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.327 1.051 . . . . 0.0 109.443 172.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -134.45 146.27 49.64 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.861 1.264 . . . . 0.0 112.411 -173.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.49 ' HG ' ' N ' ' A' ' 33' ' ' MET . 14.2 m -128.14 134.49 49.1 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.572 1.549 . . . . 0.0 109.369 172.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -145.01 147.18 32.34 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.816 1.246 . . . . 0.0 111.192 -172.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 18.3 p -73.47 -39.85 64.58 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.975 1.31 . . . . 0.0 111.306 171.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 17.0 m -60.01 127.95 34.43 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.268 1.827 . . . . 0.0 111.994 173.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -65.21 -28.06 69.12 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.374 1.47 . . . . 0.0 112.864 -178.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 67.9 m -138.76 149.33 44.9 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.789 1.636 . . . . 0.0 110.738 176.295 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 52.4 p90 -163.4 162.94 25.14 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.055 1.342 . . . . 0.0 111.836 -173.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 45.6 t -95.9 132.89 38.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 125.326 1.45 . . . . 0.0 107.765 169.098 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 10.7 tp -99.41 142.43 30.9 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.418 1.487 . . . . 0.0 108.008 168.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -145.56 158.97 43.77 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.409 1.084 . . . . 0.0 113.191 -176.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 16.1 t90 -134.43 141.04 46.68 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.438 1.095 . . . . 0.0 112.512 -170.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -136.92 147.99 46.73 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -172.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 55.5 ttt85 -99.78 129.99 45.94 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 166.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 24.7 tpp -98.49 127.31 44.37 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.258 1.823 . . . . 0.0 109.382 179.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 44.9 m -90.84 160.59 37.91 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 125.469 1.508 . . . . 0.0 113.052 -174.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -67.44 -18.7 49.53 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 123.263 2.642 . . . . 0.0 112.827 173.024 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 42.5 p -76.92 -3.78 40.5 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.657 1.583 . . . . 0.0 113.367 169.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 32.0 m-80 73.77 20.8 2.88 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 128.287 2.635 . . . . 0.0 113.464 179.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.3 pp0? -97.75 169.59 9.57 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.818 0.847 . . . . 0.0 111.497 169.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.6 p -130.16 137.34 50.06 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.181 1.393 . . . . 0.0 110.395 -176.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -118.65 131.53 56.17 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.825 1.25 . . . . 0.0 111.219 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 76.9 tttt -75.93 132.44 40.26 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.73 1.212 . . . . 0.0 111.323 -175.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 76.1 mt -111.48 -47.14 3.2 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.689 1.196 . . . . 0.0 112.435 -170.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -167.74 169.72 11.48 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.607 1.563 . . . . 0.0 110.938 -175.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -158.72 159.39 35.19 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.078 1.351 . . . . 0.0 112.501 -177.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -145.78 118.26 5.15 Favored Pre-proline 0 CA--C 1.548 0.9 0 C-N-CA 125.676 1.591 . . . . 0.0 110.866 175.402 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -52.98 159.12 11.1 Favored 'Cis proline' 0 C--N 1.351 0.676 0 CA-C-N 119.997 1.035 . . . . 0.0 112.592 -12.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -68.32 94.55 0.54 Allowed 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 122.561 1.172 . . . . 0.0 112.937 -171.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -94.64 10.44 34.84 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 127.298 2.239 . . . . 0.0 112.209 173.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.24 -14.48 60.79 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.864 1.666 . . . . 0.0 114.435 177.328 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 33.0 t 70.02 -60.96 0.47 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 127.764 2.426 . . . . 0.0 115.291 169.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.2 mm-40 -108.01 155.06 40.72 Favored Pre-proline 0 CA--C 1.543 0.681 0 C-N-CA 124.59 1.156 . . . . 0.0 113.121 -168.109 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -75.78 1.28 8.27 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 124.03 3.153 . . . . 0.0 113.786 175.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -89.96 -1.74 75.93 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 125.505 1.526 . . . . 0.0 113.707 178.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 37.8 tp60 -68.48 134.38 50.02 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.053 0.941 . . . . 0.0 109.861 173.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 53.3 t0 -68.72 108.2 3.3 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 123.856 0.862 . . . . 0.0 111.595 177.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 21.0 m -65.78 -11.99 50.43 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 115.116 1.525 . . . . 0.0 115.116 -172.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 41.0 mtm180 -58.17 -41.87 84.79 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.491 1.116 . . . . 0.0 112.82 174.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -67.61 111.28 4.09 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.397 1.079 . . . . 0.0 110.038 171.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 44.3 ttp85 -120.5 139.8 52.36 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.351 1.86 . . . . 0.0 111.436 -173.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 8.6 t -109.82 131.23 61.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 125.021 1.328 . . . . 0.0 108.845 168.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 73.7 m -130.12 135.73 48.53 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.326 1.05 . . . . 0.0 109.731 172.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -92.7 126.97 38.02 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.047 1.339 . . . . 0.0 109.464 -176.025 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 86.6 mt -90.66 151.48 43.94 Favored Pre-proline 0 N--CA 1.472 0.662 0 C-N-CA 123.837 0.855 . . . . 0.0 112.968 -174.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -64.62 -2.41 5.18 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 123.783 2.989 . . . . 0.0 114.058 176.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -64.92 -25.97 68.11 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 119.572 1.078 . . . . 0.0 112.648 169.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 95.57 -34.09 5.08 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 126.209 1.861 . . . . 0.0 114.016 176.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 46.2 mtm105 -138.32 73.64 1.45 Allowed 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.117 1.367 . . . . 0.0 109.615 169.359 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -165.11 140.38 5.26 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 127.77 2.428 . . . . 0.0 107.132 177.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -143.7 134.85 25.68 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 -167.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.4 t-160 -96.16 113.41 25.01 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 127.452 2.301 . . . . 0.0 110.341 -177.094 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 24.9 mmt -107.7 105.64 15.59 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.875 1.67 . . . . 0.0 109.782 179.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 8.2 t -116.48 125.27 51.72 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -169.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 21.4 t -87.93 88.8 2.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 N-CA-C 106.036 -1.838 . . . . 0.0 106.036 167.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 87.7 t -65.79 119.37 10.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 178.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 62.6 72.29 0.5 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.804 1.641 . . . . 0.0 111.308 -177.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -80.39 139.2 36.63 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.31 1.044 . . . . 0.0 112.088 178.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -112.07 170.05 8.42 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.976 1.71 . . . . 0.0 109.847 175.122 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 27.7 mtp180 -56.23 -34.98 66.84 Favored 'General case' 0 N--CA 1.48 1.066 0 O-C-N 120.86 -1.15 . . . . 0.0 113.436 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 23.7 p30 -63.96 -18.72 64.55 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 115.161 1.541 . . . . 0.0 115.161 175.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -80.56 -7.35 59.21 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.071 0.948 . . . . 0.0 112.656 174.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.4 m -61.85 134.89 57.27 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.086 -1.634 . . . . 0.0 111.11 171.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 159.96 -169.2 35.85 Favored Glycine 0 N--CA 1.471 0.979 0 C-N-CA 124.334 0.969 . . . . 0.0 113.315 -177.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 7.7 m -91.84 142.71 27.28 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.349 1.06 . . . . 0.0 110.319 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -138.98 155.82 47.71 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.539 1.536 . . . . 0.0 111.967 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -159.55 154.56 24.9 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.188 1.395 . . . . 0.0 112.877 178.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 3.3 t -107.91 167.01 10.28 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.091 1.756 . . . . 0.0 111.342 -173.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -159.76 168.79 35.63 Favored Glycine 0 CA--C 1.527 0.818 0 O-C-N 121.196 -0.94 . . . . 0.0 114.208 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -143.9 155.59 44.14 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.954 1.302 . . . . 0.0 112.152 174.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.8 tt -155.68 138.05 6.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 125.652 1.581 . . . . 0.0 110.888 178.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 4.8 m -64.51 161.52 17.14 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.458 1.103 . . . . 0.0 113.067 179.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 43.6 mt -74.24 -16.79 60.94 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 -178.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -69.37 150.11 97.16 Favored Pre-proline 0 CA--C 1.552 1.027 0 C-N-CA 124.619 1.167 . . . . 0.0 112.642 178.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.59 -20.93 35.01 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 123.106 2.537 . . . . 0.0 113.1 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -82.93 0.84 42.53 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 124.784 1.234 . . . . 0.0 113.964 178.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.68 168.52 13.0 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.167 1.387 . . . . 0.0 113.83 -176.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -147.28 156.29 42.8 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.859 1.663 . . . . 0.0 110.038 175.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 52.8 mt -81.57 127.03 39.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 123.082 0.553 . . . . 0.0 111.303 -171.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -95.09 114.49 26.3 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.251 1.82 . . . . 0.0 108.17 168.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -94.52 150.43 20.26 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.46 1.104 . . . . 0.0 111.866 -176.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 60.2 p -85.59 176.64 8.08 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.777 0.831 . . . . 0.0 112.498 169.05 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -69.7 159.88 32.68 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 121.676 -0.64 . . . . 0.0 109.988 165.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -93.44 159.85 15.07 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 -176.2 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -140.65 163.87 31.72 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.412 1.885 . . . . 0.0 111.827 178.161 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -105.28 138.88 40.78 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.105 1.362 . . . . 0.0 112.199 177.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 42.7 tp -108.52 131.37 54.9 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 126.343 1.857 . . . . 0.0 107.652 167.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 30.4 ttm180 -133.78 113.23 12.07 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 124.456 1.102 . . . . 0.0 109.532 -177.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 30.8 t -107.08 112.81 41.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 C-N-CA 124.394 1.078 . . . . 0.0 109.301 -175.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 72.7 p -93.44 160.43 14.81 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 126.622 1.969 . . . . 0.0 111.177 -176.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -62.5 142.91 57.71 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.857 0.863 . . . . 0.0 113.226 -172.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -65.22 116.71 6.86 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.473 1.109 . . . . 0.0 108.747 176.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 36.8 ptt180 -66.73 156.51 35.18 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.332 0.864 . . . . 0.0 113.332 -173.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -79.21 145.41 33.63 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 123.852 0.861 . . . . 0.0 111.001 169.317 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 60.5 mt-10 . . . . . 0 C--O 1.254 1.336 0 C-N-CA 125.921 1.688 . . . . 0.0 112.395 -177.033 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 78.6 mmm . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 116.043 -1.932 . . . . 0.0 113.084 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_exo -53.67 155.17 14.27 Favored 'Trans proline' 0 C--N 1.358 1.027 0 C-N-CA 122.903 2.402 . . . . 0.0 112.675 172.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -67.35 109.2 1.73 Allowed 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 123.478 2.785 . . . . 0.0 110.357 -175.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 58.7 m -130.76 148.16 52.51 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.098 1.359 . . . . 0.0 110.504 -169.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 93.9 t80 -140.37 116.95 10.83 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 126.972 2.109 . . . . 0.0 108.214 174.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 38.1 m -140.83 160.95 56.64 Favored Pre-proline 0 N--CA 1.479 0.983 0 C-N-CA 124.545 1.138 . . . . 0.0 113.494 -168.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -68.53 156.88 88.86 Favored 'Cis proline' 0 C--N 1.355 0.897 0 CA-C-N 119.982 1.029 . . . . 0.0 111.751 -2.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.33 -28.07 64.72 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.802 0.841 . . . . 0.0 113.074 175.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -134.96 118.13 16.53 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 126.224 1.81 . . . . 0.0 109.187 173.157 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 51.7 tp -109.1 122.3 47.0 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.963 0.905 . . . . 0.0 109.761 171.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 32.2 t -106.84 122.92 61.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 124.132 0.973 . . . . 0.0 109.269 175.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.0 m -128.98 172.34 15.5 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 C-N-CA 125.04 1.336 . . . . 0.0 112.036 170.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 31.9 m -99.14 151.82 20.56 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.812 1.645 . . . . 0.0 110.693 177.195 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -47.19 122.07 4.25 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.998 1.319 . . . . 0.0 112.013 169.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 85.79 -1.85 87.95 Favored Glycine 0 CA--C 1.532 1.123 0 C-N-CA 125.736 1.636 . . . . 0.0 114.576 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 39.4 t0 -87.09 157.41 19.41 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.245 1.523 . . . . 0.0 111.393 175.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -84.08 150.62 25.45 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 121.903 0.859 . . . . 0.0 111.302 169.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -132.41 131.25 41.6 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.267 1.827 . . . . 0.0 110.03 -175.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 89.8 m -131.58 127.05 36.33 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.286 0.948 . . . . 0.0 111.82 179.167 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -100.11 159.54 15.02 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.002 1.721 . . . . 0.0 110.516 169.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 58.8 m -110.32 132.5 54.12 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.661 1.584 . . . . 0.0 109.88 174.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 39.5 t -116.73 144.1 44.86 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.991 1.716 . . . . 0.0 112.003 173.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 80.9 p -151.41 140.51 21.18 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.713 0.805 . . . . 0.0 112.115 171.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -131.09 156.15 45.71 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.49 1.916 . . . . 0.0 112.754 -174.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 26.5 t -93.96 130.15 40.17 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.072 0.949 . . . . 0.0 109.09 167.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -144.15 156.55 44.37 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.991 1.316 . . . . 0.0 110.828 -174.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.0 t -74.61 -173.62 1.85 Allowed 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.093 0.957 . . . . 0.0 111.765 175.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 3.0 t -81.9 39.66 0.57 Allowed 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 125.812 1.645 . . . . 0.0 112.404 178.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -144.28 148.97 35.54 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 126.848 2.059 . . . . 0.0 109.248 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 28.4 m -69.33 156.6 38.52 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 122.851 1.31 . . . . 0.0 114.368 -173.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 54.2 p90 -146.86 155.77 42.58 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.272 1.429 . . . . 0.0 111.999 -175.222 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.3 t -96.01 135.76 29.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 125.594 1.557 . . . . 0.0 107.646 169.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -119.41 129.23 54.68 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.169 1.388 . . . . 0.0 108.841 -175.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -130.94 155.72 46.31 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.282 1.433 . . . . 0.0 113.144 -168.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 18.2 t90 -123.32 139.09 54.39 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.662 1.185 . . . . 0.0 112.257 179.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -133.07 147.66 52.18 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.214 1.406 . . . . 0.0 113.665 -173.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 51.2 ttp180 -110.28 141.11 43.73 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 127.419 2.288 . . . . 0.0 108.567 169.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 38.2 mtp -92.94 145.87 24.05 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.252 0.933 . . . . 0.0 112.155 178.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 24.0 p -90.85 165.54 21.87 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 123.626 0.77 . . . . 0.0 112.983 176.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.01 -29.04 89.59 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 123.589 2.859 . . . . 0.0 113.358 169.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 36.1 m -83.39 12.46 5.45 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.195 1.398 . . . . 0.0 112.89 174.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 63.4 t30 63.44 23.56 13.74 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.554 1.941 . . . . 0.0 113.353 178.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 46.4 mm-40 -89.7 -172.73 3.67 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.483 0.713 . . . . 0.0 109.798 170.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.4 p -137.58 143.5 41.55 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.347 1.459 . . . . 0.0 110.902 -176.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -123.73 129.77 51.61 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 126.572 1.949 . . . . 0.0 109.775 -178.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 74.3 tttt -86.6 119.66 27.08 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.604 1.162 . . . . 0.0 110.962 -171.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 65.9 mt -95.04 -51.07 4.81 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.696 1.199 . . . . 0.0 112.381 -168.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -167.37 171.72 10.34 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.321 1.448 . . . . 0.0 111.564 -174.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -150.09 158.36 44.08 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.104 1.362 . . . . 0.0 113.112 -169.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -137.26 136.94 21.33 Favored Pre-proline 0 CA--C 1.548 0.895 0 C-N-CA 125.687 1.595 . . . . 0.0 110.203 169.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -58.25 143.82 26.63 Favored 'Cis proline' 0 C--N 1.352 0.75 0 CA-C-N 120.279 1.136 . . . . 0.0 112.089 -8.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -88.04 152.81 21.75 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.248 1.019 . . . . 0.0 112.991 -173.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -153.25 136.81 15.95 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.095 1.358 . . . . 0.0 111.454 171.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -100.04 -8.88 23.29 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.714 1.606 . . . . 0.0 113.19 176.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 12.0 m -75.69 -35.79 60.24 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.297 -0.877 . . . . 0.0 112.435 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -69.83 159.97 81.91 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 124.145 0.978 . . . . 0.0 112.98 173.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -61.09 152.84 68.67 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 123.263 2.642 . . . . 0.0 111.31 167.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 99.96 17.29 25.77 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 124.023 0.82 . . . . 0.0 113.848 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -61.04 135.55 57.81 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.143 0.977 . . . . 0.0 110.81 173.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -142.89 148.83 37.63 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.441 1.496 . . . . 0.0 111.602 -178.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 54.5 p -101.4 -7.73 22.65 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 115.673 1.731 . . . . 0.0 115.673 -172.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.3 ptp85 -123.98 -18.97 5.79 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 115.247 1.573 . . . . 0.0 115.247 -169.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -111.88 140.48 46.5 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.714 1.606 . . . . 0.0 111.138 177.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 21.2 ttt-85 -144.4 143.72 31.06 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.832 0.853 . . . . 0.0 113.024 174.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 60.1 t -111.75 127.15 69.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 125.154 1.381 . . . . 0.0 107.704 167.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 76.3 m -130.55 129.55 42.96 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.09 0.956 . . . . 0.0 109.954 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -80.27 139.74 36.52 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.49 0.716 . . . . 0.0 110.978 176.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 30.6 mt -84.56 160.38 56.52 Favored Pre-proline 0 CA--C 1.545 0.766 0 C-N-CA 124.906 1.282 . . . . 0.0 111.669 176.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -62.32 -5.07 6.11 Favored 'Trans proline' 0 CA--C 1.543 0.931 0 C-N-CA 123.542 2.828 . . . . 0.0 114.704 174.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -62.64 -26.13 68.47 Favored 'General case' 0 CA--C 1.551 1.019 0 CA-C-N 119.569 1.077 . . . . 0.0 112.746 169.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 94.08 -17.06 59.56 Favored Glycine 0 N--CA 1.475 1.274 0 C-N-CA 125.59 1.567 . . . . 0.0 114.692 173.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 11.0 ptp180 -154.5 73.61 0.91 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.477 1.511 . . . . 0.0 109.839 169.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -166.44 140.6 4.19 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 128.652 2.781 . . . . 0.0 107.003 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -141.16 143.04 34.02 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 -166.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 17.1 m170 -105.55 132.84 51.21 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.524 1.529 . . . . 0.0 111.711 169.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -112.73 101.82 9.9 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 127.154 2.182 . . . . 0.0 109.298 -178.023 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 60.6 m -109.23 124.12 50.35 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 -169.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 37.2 t -93.53 125.99 46.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 126.278 1.831 . . . . 0.0 106.401 167.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 57.9 t -96.57 126.57 49.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 124.069 0.948 . . . . 0.0 109.408 171.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 67.1 ttt180 58.32 66.15 1.15 Allowed 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.778 1.631 . . . . 0.0 111.826 174.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -72.37 135.54 45.89 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 121.351 -0.843 . . . . 0.0 111.798 -178.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -111.49 164.86 12.52 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.93 1.692 . . . . 0.0 110.202 174.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 31.0 mtp180 -56.88 -32.99 66.41 Favored 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -171.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -64.97 -16.11 62.99 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 175.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 65.5 m-20 -79.73 -13.52 59.39 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 119.329 0.968 . . . . 0.0 112.8 173.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 20.4 m -63.45 129.23 39.36 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 120.868 -1.145 . . . . 0.0 111.566 177.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 158.8 -169.04 35.07 Favored Glycine 0 N--CA 1.47 0.908 0 C-N-CA 124.183 0.896 . . . . 0.0 113.286 -172.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.4 m -92.79 143.27 26.45 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.727 1.211 . . . . 0.0 111.267 -173.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -141.73 157.19 45.35 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.542 1.937 . . . . 0.0 111.267 -177.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -160.53 159.93 31.29 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.855 1.262 . . . . 0.0 113.617 177.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 39.1 t -103.07 149.47 24.56 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.911 1.685 . . . . 0.0 111.57 177.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -144.57 152.64 24.55 Favored Glycine 0 N--CA 1.471 1.015 0 C-N-CA 124.688 1.137 . . . . 0.0 113.182 175.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -132.39 154.63 49.62 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.629 1.171 . . . . 0.0 112.775 -176.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.3 tt -153.31 135.41 6.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 125.104 1.361 . . . . 0.0 110.995 177.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 12.6 m -67.98 158.28 33.17 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 121.099 -1.001 . . . . 0.0 112.498 177.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.7 -9.18 56.6 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 115.689 1.737 . . . . 0.0 115.689 -177.247 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -78.38 144.16 65.67 Favored Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 124.241 1.016 . . . . 0.0 112.281 -178.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -55.56 -29.04 68.01 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 123.748 2.965 . . . . 0.0 114.858 177.22 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -76.99 -5.99 50.85 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 115.056 1.502 . . . . 0.0 115.056 179.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.41 164.2 23.54 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.519 1.127 . . . . 0.0 113.365 -176.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -144.59 161.34 39.37 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.674 1.589 . . . . 0.0 110.295 173.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 56.8 mt -78.98 118.17 25.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 123.65 0.78 . . . . 0.0 111.158 -172.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 59.0 tttp -89.62 137.53 32.25 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.719 1.608 . . . . 0.0 109.214 168.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -115.29 152.75 32.18 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.448 1.099 . . . . 0.0 112.147 -173.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 78.3 p -97.59 172.55 7.65 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.077 1.351 . . . . 0.0 114.118 177.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 14.4 tp -69.99 119.8 14.75 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.144 1.378 . . . . 0.0 108.607 169.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 34.8 ptt-85 -71.35 163.93 26.72 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.101 1.36 . . . . 0.0 113.879 -175.041 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -142.64 169.65 17.18 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.807 2.043 . . . . 0.0 111.234 179.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -117.65 146.16 43.87 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 114.055 1.131 . . . . 0.0 114.055 174.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 66.8 tp -100.21 137.11 39.1 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 127.112 2.165 . . . . 0.0 108.875 169.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 29.3 ttm180 -132.02 117.56 18.55 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.293 1.437 . . . . 0.0 109.964 178.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 40.6 t -106.46 113.21 42.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 125.226 1.41 . . . . 0.0 108.904 178.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 73.8 p -95.01 160.69 14.46 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.824 1.65 . . . . 0.0 111.47 -178.349 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -57.74 144.9 36.46 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.732 1.213 . . . . 0.0 113.686 -173.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 69.7 ttp85 -66.63 118.2 9.87 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 124.278 1.031 . . . . 0.0 109.607 179.38 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.71 152.65 45.25 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -175.193 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -64.72 154.29 37.17 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.364 1.066 . . . . 0.0 113.447 179.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 . . . . . 0 N--CA 1.49 1.533 0 C-N-CA 130.605 3.562 . . . . 0.0 113.022 176.718 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . 0.613 ' N ' ' HG ' ' A' ' 55' ' ' SER . 4.7 mpp? . . . . . 0 N--CA 1.489 1.498 0 CA-C-O 116.768 -1.587 . . . . 0.0 114.418 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -73.06 159.73 47.12 Favored 'Trans proline' 0 C--N 1.357 0.988 0 C-N-CA 122.436 2.091 . . . . 0.0 112.218 -173.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -64.75 114.59 2.82 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 124.008 3.138 . . . . 0.0 111.535 -178.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.1 t -167.68 163.3 14.37 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.826 1.25 . . . . 0.0 113.221 -174.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -152.78 119.88 5.84 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.66 1.984 . . . . 0.0 110.658 175.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 94.9 p -140.93 164.19 37.72 Favored Pre-proline 0 CA--C 1.553 1.075 0 C-N-CA 125.446 1.498 . . . . 0.0 112.755 -172.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -70.24 170.65 59.52 Favored 'Cis proline' 0 C--N 1.355 0.873 0 CA-C-N 120.629 1.26 . . . . 0.0 112.396 -2.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.04 -32.94 74.42 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 171.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 49.1 tp -144.92 124.69 13.36 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.559 1.544 . . . . 0.0 109.586 171.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 62.1 tp -102.18 132.75 47.9 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.975 1.31 . . . . 0.0 108.888 169.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 24.7 t -112.65 127.29 69.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 124.072 0.949 . . . . 0.0 108.466 171.037 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 33.2 m -131.4 166.26 29.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 124.624 1.17 . . . . 0.0 111.708 175.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 25.4 m -90.5 148.91 22.43 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.258 1.023 . . . . 0.0 110.229 173.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -59.13 116.05 3.59 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.544 1.538 . . . . 0.0 111.357 176.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.17 5.47 65.7 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 126.385 1.945 . . . . 0.0 114.765 -174.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -92.05 154.78 18.54 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.355 1.578 . . . . 0.0 112.132 173.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -71.08 120.44 16.65 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.455 1.102 . . . . 0.0 110.753 173.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -97.9 128.09 44.27 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 117.867 -1.063 . . . . 0.0 110.076 174.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 28.4 m -132.74 132.08 41.89 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.169 0.988 . . . . 0.0 111.184 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -119.97 159.55 24.5 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 128.03 2.532 . . . . 0.0 109.982 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 49.7 m -105.44 124.44 49.55 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.332 1.053 . . . . 0.0 109.468 178.216 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 54.1 t -118.45 150.37 39.69 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.849 1.259 . . . . 0.0 110.908 169.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.613 ' HG ' ' N ' ' A' ' 33' ' ' MET . 27.4 t -152.9 146.49 25.04 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 120.734 -1.229 . . . . 0.0 111.763 169.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 48.3 m-85 -146.24 156.11 43.15 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 127.981 2.513 . . . . 0.0 110.887 172.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.7 t -141.34 142.87 33.78 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.083 1.353 . . . . 0.0 109.369 169.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -139.36 155.29 47.76 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.606 1.162 . . . . 0.0 112.184 -173.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 24.3 p -83.83 -16.41 44.67 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 126.097 1.759 . . . . 0.0 114.388 -173.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 7.3 t -81.72 -176.93 6.33 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.89 0.876 . . . . 0.0 112.613 176.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -73.07 -23.22 60.53 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.861 1.264 . . . . 0.0 113.498 -172.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.7 t -169.14 166.52 10.8 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.11 1.764 . . . . 0.0 110.798 -179.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -150.57 151.2 32.24 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.667 1.187 . . . . 0.0 112.171 177.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 24.8 t -96.05 133.58 36.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 125.48 1.512 . . . . 0.0 107.853 172.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 14.6 tp -99.42 140.76 33.13 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.445 1.098 . . . . 0.0 110.088 172.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -132.32 151.98 51.61 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.466 1.906 . . . . 0.0 110.507 -179.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 14.1 t90 -125.9 146.15 49.96 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.091 0.956 . . . . 0.0 112.405 178.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -141.07 143.52 34.4 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 -169.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -103.96 142.05 35.1 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.05 1.34 . . . . 0.0 107.951 167.126 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 22.6 mtp -88.49 145.91 25.48 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 118.897 0.771 . . . . 0.0 112.659 179.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 64.5 m -96.1 152.26 38.76 Favored Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 125.134 1.374 . . . . 0.0 110.923 171.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -67.52 -12.62 36.32 Favored 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 123.632 2.888 . . . . 0.0 113.621 -179.4 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 29.1 p -76.96 4.04 10.84 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 126.255 1.822 . . . . 0.0 113.633 169.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 59.8 t30 67.04 41.51 2.63 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.88 2.072 . . . . 0.0 111.347 -174.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 21.5 mm-40 -121.46 -172.69 2.47 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.59 1.956 . . . . 0.0 109.594 176.037 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 12.5 p -146.3 152.56 39.34 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.102 1.361 . . . . 0.0 111.404 -172.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -127.04 132.37 50.72 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.988 1.315 . . . . 0.0 110.919 173.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -78.75 124.98 28.76 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.484 1.114 . . . . 0.0 111.21 -175.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 74.0 mt -100.66 -44.61 5.77 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.341 1.456 . . . . 0.0 112.829 -169.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -166.21 170.92 12.79 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.165 1.786 . . . . 0.0 110.638 -171.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -155.93 163.43 39.76 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.661 1.184 . . . . 0.0 112.796 -177.017 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -141.8 121.31 8.1 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 125.269 1.428 . . . . 0.0 110.035 169.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -54.83 146.97 18.47 Favored 'Cis proline' 0 C--N 1.352 0.736 0 CA-C-N 120.378 1.171 . . . . 0.0 112.984 -7.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -80.41 144.07 32.95 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 121.976 0.893 . . . . 0.0 113.293 -170.327 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -85.11 33.46 0.54 Allowed 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.818 1.647 . . . . 0.0 113.062 -174.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 6.9 ppt_? -63.56 -8.13 8.92 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 115.799 1.778 . . . . 0.0 115.799 -169.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 33.1 p -73.21 -19.42 61.09 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.648 1.179 . . . . 0.0 113.116 171.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -106.17 164.58 14.65 Favored Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 125.48 1.512 . . . . 0.0 111.118 174.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_exo -56.66 160.66 11.31 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 124.061 3.174 . . . . 0.0 113.942 173.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 91.94 31.11 9.49 Favored Glycine 0 CA--C 1.533 1.201 0 C-N-CA 124.17 0.891 . . . . 0.0 113.135 -174.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -72.37 -20.87 61.38 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.846 1.258 . . . . 0.0 113.445 -175.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -142.94 55.4 1.39 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.151 1.38 . . . . 0.0 111.286 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 50.8 m -84.21 9.45 12.8 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.976 1.31 . . . . 0.0 113.866 178.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 43.7 mtm180 80.63 -34.13 0.12 Allowed 'General case' 0 C--N 1.346 0.432 0 C-N-CA 131.493 3.917 . . . . 0.0 113.803 178.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -65.03 129.46 39.79 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.356 1.462 . . . . 0.0 110.813 169.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 59.0 ttp85 -144.45 154.0 42.48 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.733 1.613 . . . . 0.0 112.102 -170.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 17.7 t -117.54 138.02 49.57 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 125.994 1.718 . . . . 0.0 110.166 173.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 3.1 m -114.54 128.38 56.3 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.237 1.415 . . . . 0.0 110.153 171.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 28.0 tp60 -84.84 122.38 29.07 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.531 1.132 . . . . 0.0 108.222 168.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 24.6 mt -84.56 154.96 62.52 Favored Pre-proline 0 N--CA 1.472 0.668 0 CA-C-O 118.766 -0.635 . . . . 0.0 110.751 176.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -65.95 -4.93 10.99 Favored 'Trans proline' 0 CA--C 1.54 0.777 0 C-N-CA 123.571 2.847 . . . . 0.0 113.926 176.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -64.95 -26.12 68.17 Favored 'General case' 0 CA--C 1.55 0.96 0 CA-C-N 119.434 1.016 . . . . 0.0 112.182 169.168 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 85.44 -34.09 3.34 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 126.592 2.044 . . . . 0.0 113.867 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 17.2 mtp180 -125.88 73.51 1.35 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.771 1.228 . . . . 0.0 109.197 174.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 174.12 142.2 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 128.757 2.823 . . . . 0.0 109.057 -174.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 84.6 m-85 -149.79 151.46 33.6 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.553 1.141 . . . . 0.0 112.66 -167.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 5.8 m-70 -116.34 114.48 24.37 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.512 0.725 . . . . 0.0 111.344 169.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 24.6 mmt -84.23 144.04 29.19 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.293 1.037 . . . . 0.0 109.371 172.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 72.3 p -151.36 151.77 32.21 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 115.565 1.691 . . . . 0.0 115.565 -179.146 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 16.0 t -109.69 116.2 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 125.526 1.531 . . . . 0.0 107.466 169.318 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 96.9 t -70.86 112.52 5.78 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 170.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 80.5 mtt85 57.49 77.09 0.29 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.392 1.477 . . . . 0.0 111.317 178.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.29 132.88 45.56 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.595 1.158 . . . . 0.0 111.325 -179.437 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 8.6 mpt_? -105.84 163.26 12.86 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.767 1.627 . . . . 0.0 109.989 176.143 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 73.9 mtm180 -57.52 -20.23 30.12 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 175.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -54.59 -29.95 53.06 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.977 1.711 . . . . 0.0 113.668 167.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 36.4 m-20 -93.21 -12.74 29.52 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.059 1.344 . . . . 0.0 114.551 -168.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 49.5 m -59.42 139.46 57.06 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 119.602 1.092 . . . . 0.0 112.768 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 149.35 -163.83 29.27 Favored Glycine 0 N--CA 1.472 1.053 0 C-N-CA 124.131 0.872 . . . . 0.0 113.435 -178.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.7 m -92.64 147.53 22.8 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.006 1.322 . . . . 0.0 110.702 -178.063 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -142.29 158.75 43.37 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.641 1.976 . . . . 0.0 111.253 -176.126 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.5 pp -154.36 158.84 40.69 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.914 1.286 . . . . 0.0 112.112 172.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 9.3 t -108.45 161.48 15.0 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.071 1.748 . . . . 0.0 110.291 177.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -157.46 155.3 26.29 Favored Glycine 0 N--CA 1.47 0.943 0 O-C-N 120.945 -1.097 . . . . 0.0 114.36 176.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -130.58 154.2 48.09 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.433 1.093 . . . . 0.0 112.818 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.6 tt -148.21 135.3 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 125.428 1.491 . . . . 0.0 110.528 176.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 23.3 m -67.04 161.1 25.16 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -179.285 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.26 -17.5 64.55 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 -175.657 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -78.51 148.9 74.33 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 124.744 1.218 . . . . 0.0 112.473 -177.36 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -67.9 -23.08 41.5 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.108 2.539 . . . . 0.0 113.069 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.8 pttp -80.31 -1.76 42.36 Favored 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 114.654 1.353 . . . . 0.0 114.654 176.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -67.83 164.32 19.89 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.731 1.212 . . . . 0.0 113.135 -179.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -137.05 155.77 49.24 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.771 1.628 . . . . 0.0 109.394 176.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 50.8 mt -79.24 125.25 38.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 123.343 0.657 . . . . 0.0 110.673 -176.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -95.69 120.91 36.79 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.899 1.68 . . . . 0.0 109.414 169.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -91.57 151.81 20.57 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.661 1.185 . . . . 0.0 112.223 -177.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 56.0 p -85.99 178.96 7.09 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.347 1.059 . . . . 0.0 112.426 169.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -71.67 159.33 34.59 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.523 -0.735 . . . . 0.0 110.688 166.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 70.3 mtt180 -75.41 143.43 42.73 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 123.991 0.916 . . . . 0.0 112.172 -178.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -124.17 166.46 15.79 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.749 2.02 . . . . 0.0 110.105 169.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -126.66 152.76 46.29 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.579 1.151 . . . . 0.0 111.707 177.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 64.7 tp -125.35 132.9 52.75 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 126.181 1.792 . . . . 0.0 109.4 172.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 53.9 ttp180 -123.0 117.19 24.91 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.948 1.299 . . . . 0.0 109.875 169.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 40.8 t -96.29 120.37 45.57 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 169.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 82.8 p -99.07 149.29 23.17 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.752 1.621 . . . . 0.0 109.932 177.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 38.8 mp0 -53.31 149.01 7.83 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.8 1.24 . . . . 0.0 113.402 -174.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -62.6 123.48 18.47 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 124.543 1.137 . . . . 0.0 109.667 -178.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 66.2 mtt-85 -76.12 153.31 36.37 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.874 0.87 . . . . 0.0 112.835 -167.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -71.49 154.38 41.53 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.554 1.142 . . . . 0.0 112.424 175.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 . . . . . 0 C--O 1.252 1.184 0 C-N-CA 125.186 1.394 . . . . 0.0 112.998 176.907 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 5.3 mpp? . . . . . 0 N--CA 1.489 1.477 0 CA-C-O 118.65 -0.691 . . . . 0.0 110.445 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -77.21 171.1 18.39 Favored 'Trans proline' 0 CA--C 1.547 1.128 0 C-N-CA 123.842 3.028 . . . . 0.0 111.875 175.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_exo -54.04 144.03 59.27 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 124.249 3.299 . . . . 0.0 112.22 168.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 17.0 p -136.64 137.79 40.44 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.59 1.156 . . . . 0.0 111.185 -178.058 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -120.85 140.09 52.25 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.97 1.308 . . . . 0.0 110.527 -174.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 16.9 m -140.91 156.76 68.47 Favored Pre-proline 0 CA--C 1.547 0.855 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 178.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -71.1 155.13 96.94 Favored 'Cis proline' 0 C--N 1.35 0.655 0 N-CA-C 110.367 -0.666 . . . . 0.0 110.367 -12.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.68 -30.19 67.18 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 173.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 46.0 tp -138.53 118.86 13.67 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.645 1.578 . . . . 0.0 109.095 170.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.4 tp -101.19 126.89 47.95 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.241 1.416 . . . . 0.0 109.229 172.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.6 t -109.79 124.54 66.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 171.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.8 m -128.09 174.28 11.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 C-N-CA 124.814 1.245 . . . . 0.0 111.284 172.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 33.8 m -104.34 151.85 22.96 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.657 1.583 . . . . 0.0 110.281 174.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -45.25 122.87 3.66 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.082 1.753 . . . . 0.0 112.509 171.728 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.27 0.42 89.48 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 125.902 1.715 . . . . 0.0 115.126 -179.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -88.08 155.77 19.63 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 119.768 1.784 . . . . 0.0 112.629 177.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -76.14 121.83 23.42 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.839 1.256 . . . . 0.0 110.771 173.13 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -101.4 131.45 47.48 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.112 0.965 . . . . 0.0 110.688 175.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 21.3 m -132.76 124.96 29.07 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.822 0.849 . . . . 0.0 111.531 -178.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -104.96 159.46 15.8 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 126.041 1.736 . . . . 0.0 111.102 170.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 32.2 m -120.52 138.59 53.76 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.615 1.566 . . . . 0.0 110.052 177.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 74.4 m -128.6 137.5 51.73 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.023 1.329 . . . . 0.0 110.938 169.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 47.6 p -124.89 140.9 52.51 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.39 0.676 . . . . 0.0 109.673 170.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -127.07 140.8 52.03 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 113.988 1.107 . . . . 0.0 113.988 -169.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 12.6 p -99.12 138.49 36.15 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.671 1.588 . . . . 0.0 107.652 165.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -159.04 138.44 11.51 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.139 -0.976 . . . . 0.0 111.847 -169.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.2 p -79.75 -18.43 51.12 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 125.732 1.613 . . . . 0.0 113.979 -176.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 8.0 t -88.49 177.69 6.73 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.269 1.028 . . . . 0.0 111.839 172.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -74.1 -34.53 63.99 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.849 1.26 . . . . 0.0 111.275 176.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.1 t -160.01 174.39 14.43 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.802 1.241 . . . . 0.0 111.739 -179.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 42.7 p90 -160.82 164.14 31.6 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.493 1.517 . . . . 0.0 111.743 -169.136 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 40.7 t -95.85 125.5 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 N-CA-C 106.487 -1.671 . . . . 0.0 106.487 169.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 37.6 tp -99.38 139.33 35.19 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 123.054 0.541 . . . . 0.0 109.647 174.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -128.16 137.12 51.94 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.544 1.538 . . . . 0.0 109.997 -176.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 68.9 t-105 -98.19 134.93 40.56 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.68 1.192 . . . . 0.0 110.699 173.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 90.5 m-85 -124.2 143.42 50.52 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.913 1.285 . . . . 0.0 112.805 -178.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 56.8 ttp85 -95.83 142.96 27.48 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 126.542 1.937 . . . . 0.0 107.874 167.157 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 33.1 mtp -91.61 144.89 25.07 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 118.826 0.739 . . . . 0.0 112.206 172.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 58.8 m -108.96 149.49 39.67 Favored Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 125.559 1.543 . . . . 0.0 110.85 171.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -69.01 -14.88 39.32 Favored 'Trans proline' 0 C--N 1.353 0.784 0 C-N-CA 123.879 3.053 . . . . 0.0 114.482 -171.023 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 6.1 t -76.91 7.92 4.31 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 119.098 0.863 . . . . 0.0 113.153 170.168 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 34.3 m-80 75.6 36.79 0.45 Allowed 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 127.896 2.479 . . . . 0.0 112.039 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -115.84 172.61 7.03 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.176 1.39 . . . . 0.0 111.007 179.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.8 p -132.62 152.49 51.63 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 125.842 1.657 . . . . 0.0 111.505 -178.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -138.51 125.89 21.77 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.539 1.536 . . . . 0.0 110.927 -177.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -77.64 125.33 29.17 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.138 0.975 . . . . 0.0 111.218 -176.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 25.4 mt -102.09 -43.35 5.78 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.894 0.878 . . . . 0.0 112.944 -179.016 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -157.46 168.13 28.22 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.377 1.471 . . . . 0.0 111.455 -172.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.66 167.86 27.41 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.44 1.096 . . . . 0.0 112.862 -178.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -142.22 126.16 9.84 Favored Pre-proline 0 CA--C 1.543 0.674 0 C-N-CA 124.661 1.185 . . . . 0.0 110.33 169.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -56.76 153.83 28.38 Favored 'Cis proline' 0 C--N 1.351 0.677 0 CA-C-N 119.355 0.805 . . . . 0.0 112.725 -10.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -75.88 94.75 3.39 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 121.677 0.751 . . . . 0.0 111.659 -177.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -79.15 0.69 27.21 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.032 1.333 . . . . 0.0 113.645 173.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 64.6 mtm180 -61.24 -33.07 72.9 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.362 1.465 . . . . 0.0 112.164 176.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.7 t 70.29 -61.08 0.47 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 127.776 2.43 . . . . 0.0 115.381 168.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -101.69 149.05 36.1 Favored Pre-proline 0 CA--C 1.545 0.75 0 C-N-CA 124.446 1.099 . . . . 0.0 112.425 -169.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -80.32 164.79 21.49 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 124.06 3.173 . . . . 0.0 111.673 175.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 103.66 -5.76 47.97 Favored Glycine 0 N--CA 1.473 1.157 0 C-N-CA 125.291 1.425 . . . . 0.0 112.933 179.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.2 178.97 7.85 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.78 1.632 . . . . 0.0 111.991 171.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 19.2 m-20 -70.39 77.24 0.55 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.125 1.37 . . . . 0.0 112.363 178.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 82.0 p -68.82 -6.59 27.78 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.792 1.637 . . . . 0.0 113.933 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 5.2 ptm180 -68.6 -16.94 64.01 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.055 1.342 . . . . 0.0 113.71 171.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -97.8 125.53 42.69 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.898 1.279 . . . . 0.0 109.33 172.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -142.94 152.53 42.11 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.472 1.109 . . . . 0.0 111.945 -169.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 49.0 t -126.6 139.85 50.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.116 0 C-N-CA 124.856 1.262 . . . . 0.0 111.021 176.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 97.4 m -123.38 128.89 50.51 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.538 1.535 . . . . 0.0 109.509 170.046 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 37.2 tt0 -85.9 137.74 32.53 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.887 0.875 . . . . 0.0 110.149 170.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 34.3 mt -91.1 157.31 43.14 Favored Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 124.357 1.063 . . . . 0.0 111.894 -179.051 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -66.75 -3.85 10.08 Favored 'Trans proline' 0 CA--C 1.542 0.91 0 C-N-CA 123.664 2.91 . . . . 0.0 114.028 174.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -66.59 -13.66 61.37 Favored 'General case' 0 CA--C 1.555 1.147 0 CA-C-N 119.378 0.99 . . . . 0.0 112.951 170.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 92.32 -24.57 21.85 Favored Glycine 0 N--CA 1.476 1.307 0 C-N-CA 125.916 1.722 . . . . 0.0 115.716 168.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 11.5 ptp180 -154.5 73.64 0.92 Allowed 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.534 1.534 . . . . 0.0 109.695 172.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -168.89 137.0 2.01 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 128.074 2.55 . . . . 0.0 107.273 -171.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 55.1 m-85 -148.78 146.58 28.09 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -167.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 4.8 m-70 -106.03 132.5 52.04 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.283 1.433 . . . . 0.0 111.116 168.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 2.6 mpp? -112.1 120.31 41.4 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 126.361 1.864 . . . . 0.0 109.365 177.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 36.0 m -116.22 130.89 57.01 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.322 1.049 . . . . 0.0 112.211 -169.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 58.1 t -105.66 110.79 32.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 125.775 1.63 . . . . 0.0 107.13 168.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 96.8 t -76.29 123.44 32.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.495 1.118 . . . . 0.0 109.55 178.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 53.63 73.43 0.38 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.053 1.741 . . . . 0.0 111.574 177.047 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.87 132.26 44.15 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.195 0.998 . . . . 0.0 111.269 -179.136 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -106.94 161.65 14.53 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 126.198 1.799 . . . . 0.0 110.104 177.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -50.68 -35.79 32.69 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 119.292 0.951 . . . . 0.0 113.377 -178.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -62.88 -21.1 65.74 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 125.564 1.546 . . . . 0.0 115.003 176.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -76.4 -11.87 59.96 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 119.69 1.132 . . . . 0.0 113.116 177.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.9 m -62.93 131.08 47.5 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 120.617 -1.302 . . . . 0.0 112.349 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 156.99 -168.77 34.04 Favored Glycine 0 N--CA 1.472 1.055 0 C-N-CA 124.381 0.991 . . . . 0.0 113.703 -173.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.2 m -95.8 142.48 28.03 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.623 1.169 . . . . 0.0 111.219 -175.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -146.1 160.91 41.27 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.149 1.78 . . . . 0.0 111.071 -177.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -161.77 169.07 22.08 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 120.871 -1.143 . . . . 0.0 113.99 -175.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 6.4 m -107.06 148.26 28.96 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.178 1.391 . . . . 0.0 112.356 175.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -145.66 135.77 6.1 Favored Glycine 0 N--CA 1.469 0.859 0 C-N-CA 125.02 1.295 . . . . 0.0 111.523 169.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -113.96 157.28 22.65 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.008 0.923 . . . . 0.0 112.82 -176.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 19.7 tt -143.41 131.49 18.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 125.141 1.377 . . . . 0.0 110.226 172.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 15.3 m -68.27 161.61 26.88 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.179 1.392 . . . . 0.0 114.152 -171.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.9 -10.92 32.36 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 116.119 1.896 . . . . 0.0 116.119 -176.576 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -81.47 149.83 65.76 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.766 1.227 . . . . 0.0 112.427 -178.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -68.09 -21.5 42.63 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 123.038 2.492 . . . . 0.0 112.699 175.59 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 1.9 tppp? -81.52 -4.07 54.93 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 125.217 1.407 . . . . 0.0 113.66 177.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.5 164.69 13.5 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.813 1.245 . . . . 0.0 113.986 -175.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 38.0 tt0 -152.44 141.25 21.02 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.228 1.811 . . . . 0.0 108.437 -178.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 60.7 mt -59.62 140.5 17.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 124.189 0.996 . . . . 0.0 112.227 -172.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 32.5 mmtm -125.74 124.33 40.8 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.743 1.617 . . . . 0.0 110.306 169.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -147.74 141.92 26.12 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.119 1.767 . . . . 0.0 110.93 -174.417 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 8.4 t -173.35 156.65 3.14 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 126.259 1.824 . . . . 0.0 109.982 -179.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.1 mp 68.94 173.88 0.29 Allowed 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 127.293 2.237 . . . . 0.0 111.209 -169.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -159.63 168.22 26.57 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.611 1.564 . . . . 0.0 112.49 173.6 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -128.93 161.62 29.46 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 126.946 2.098 . . . . 0.0 110.892 173.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -116.53 139.28 50.66 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.802 1.241 . . . . 0.0 111.081 -178.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 54.4 tp -108.82 132.8 53.65 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 125.684 1.593 . . . . 0.0 109.929 171.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 66.2 ttt180 -122.49 119.38 30.75 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.901 1.68 . . . . 0.0 109.153 169.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 38.6 t -104.64 115.27 46.22 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 124.211 1.004 . . . . 0.0 108.557 171.141 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 80.8 p -87.58 153.3 21.5 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.004 1.721 . . . . 0.0 110.144 177.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 4.2 pm0 -66.52 154.58 39.98 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.696 0.798 . . . . 0.0 112.884 -178.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 19.8 tpt180 -68.6 119.37 12.93 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.99 0.916 . . . . 0.0 109.646 -173.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 75.8 ttt180 -71.4 140.86 50.29 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.136 0.575 . . . . 0.0 111.708 -172.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -70.17 154.29 42.1 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.58 1.152 . . . . 0.0 112.888 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 . . . . . 0 C--O 1.253 1.273 0 C-N-CA 124.999 1.32 . . . . 0.0 114.458 176.697 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 59.2 mtt . . . . . 0 N--CA 1.49 1.575 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.12 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -55.59 154.97 23.03 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 122.832 2.355 . . . . 0.0 110.284 167.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -58.66 109.18 0.48 Allowed 'Trans proline' 0 C--N 1.351 0.658 0 C-N-CA 123.972 3.115 . . . . 0.0 111.492 -169.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.5 t -150.2 156.16 41.08 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.487 1.115 . . . . 0.0 112.191 -169.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 82.8 t80 -145.45 118.06 8.6 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 127.419 2.288 . . . . 0.0 108.732 -175.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 97.8 p -140.84 161.56 53.38 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 124.808 1.243 . . . . 0.0 113.645 -168.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -67.67 161.53 78.85 Favored 'Cis proline' 0 C--N 1.355 0.886 0 CA-C-N 120.041 1.051 . . . . 0.0 111.707 -4.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.64 -24.75 67.76 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 176.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 13.5 tp -139.71 121.04 14.94 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 126.015 1.726 . . . . 0.0 108.487 171.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 61.3 tp -109.67 121.35 45.01 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.38 1.072 . . . . 0.0 108.591 168.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 14.3 p -109.95 126.46 67.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 123.867 0.867 . . . . 0.0 109.779 171.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 27.0 m -130.77 165.77 30.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 125.006 1.323 . . . . 0.0 111.964 176.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.3 m -89.44 147.8 23.81 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.748 1.219 . . . . 0.0 110.489 172.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -52.85 125.99 18.76 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.483 1.113 . . . . 0.0 111.393 174.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 91.06 -2.44 79.25 Favored Glycine 0 CA--C 1.534 1.231 0 C-N-CA 125.305 1.431 . . . . 0.0 114.75 -176.319 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -87.04 157.19 19.48 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 119.704 1.752 . . . . 0.0 112.275 175.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 53.6 m-20 -90.24 104.45 17.02 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.2 1.0 . . . . 0.0 110.234 178.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -90.27 111.87 23.21 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.843 0.857 . . . . 0.0 111.583 -171.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 25.8 m -113.61 125.13 53.83 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 118.716 0.689 . . . . 0.0 112.318 -173.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -101.89 159.59 15.21 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 127.094 2.158 . . . . 0.0 110.229 169.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.0 m -112.39 132.89 54.78 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.011 1.324 . . . . 0.0 109.847 174.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 43.1 t -117.51 144.4 45.11 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.765 1.626 . . . . 0.0 111.336 171.451 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 46.8 t -147.08 141.51 26.41 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.361 -0.837 . . . . 0.0 111.756 173.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -127.65 156.17 42.76 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 126.529 1.932 . . . . 0.0 113.948 -176.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 69.2 m -111.85 118.21 34.9 Favored 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 166.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -153.38 117.58 4.86 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.242 0.617 . . . . 0.0 111.722 -168.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 19.1 p -96.4 106.35 18.57 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.733 1.613 . . . . 0.0 109.648 177.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 33.0 t -172.64 167.16 5.44 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.016 1.726 . . . . 0.0 110.432 -174.264 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -73.94 -24.54 59.67 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.563 0.745 . . . . 0.0 111.366 168.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 5.3 t -170.28 164.39 8.94 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.271 1.828 . . . . 0.0 112.088 173.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 53.2 p90 -149.72 150.64 32.39 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.905 1.282 . . . . 0.0 111.48 174.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 49.1 t -96.07 128.7 47.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 C-N-CA 125.224 1.409 . . . . 0.0 107.68 173.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -112.95 122.02 46.38 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.433 1.493 . . . . 0.0 109.006 -175.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 11.4 m-80 -122.57 158.53 29.71 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.369 1.467 . . . . 0.0 112.788 -168.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 10.0 t90 -124.18 137.69 54.51 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 125.311 1.444 . . . . 0.0 112.068 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -132.99 141.09 48.11 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.786 1.234 . . . . 0.0 113.077 -176.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.5 ttt-85 -101.14 140.93 34.74 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.393 1.477 . . . . 0.0 108.258 168.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 29.8 mtp -91.98 145.92 24.15 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 119.04 0.836 . . . . 0.0 111.978 178.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 67.4 m -96.64 158.95 32.8 Favored Pre-proline 0 CA--C 1.549 0.906 0 C-N-CA 124.369 1.068 . . . . 0.0 112.064 174.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -56.57 -34.26 94.9 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 123.944 3.096 . . . . 0.0 113.654 174.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 9.6 m -77.01 18.03 0.4 Allowed 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.617 1.567 . . . . 0.0 113.529 175.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . 0.318 13.6 p30 58.01 21.04 7.37 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 128.263 2.625 . . . . 0.0 115.623 -176.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 18.7 mm100 -82.98 -178.06 6.99 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.052 0.941 . . . . 0.0 110.556 169.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -148.65 141.99 25.18 Favored 'General case' 0 CA--C 1.518 -0.271 0 C-N-CA 127.185 2.194 . . . . 0.0 108.546 -171.399 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -127.27 120.06 27.77 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 125.846 1.659 . . . . 0.0 109.359 -172.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 57.8 tttm -76.92 117.02 18.1 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.888 1.275 . . . . 0.0 110.868 -176.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 37.2 mt -94.45 -50.04 5.4 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.834 1.254 . . . . 0.0 112.966 -168.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -171.23 170.46 6.03 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.74 2.016 . . . . 0.0 110.33 -169.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.69 165.53 32.41 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.588 1.155 . . . . 0.0 112.963 -176.46 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -129.93 130.21 23.12 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 125.95 1.7 . . . . 0.0 109.268 169.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -57.74 149.59 32.91 Favored 'Cis proline' 0 C--N 1.351 0.67 0 CA-C-N 120.359 1.164 . . . . 0.0 112.734 -7.026 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -76.34 152.86 36.24 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.981 0.912 . . . . 0.0 113.26 -174.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -129.87 125.13 34.88 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.266 1.427 . . . . 0.0 110.355 173.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -101.7 1.89 38.01 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.144 1.378 . . . . 0.0 113.704 -178.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 55.1 m -105.58 -29.94 9.83 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.743 1.217 . . . . 0.0 113.44 -173.306 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 18.6 mm100 -72.72 145.36 86.95 Favored Pre-proline 0 CA--C 1.546 0.813 0 O-C-N 121.453 -0.779 . . . . 0.0 111.958 -179.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -79.95 0.57 9.92 Favored 'Trans proline' 0 CA--C 1.538 0.693 0 C-N-CA 123.843 3.029 . . . . 0.0 114.385 -173.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -85.86 -0.52 87.5 Favored Glycine 0 CA--C 1.533 1.2 0 C-N-CA 125.011 1.291 . . . . 0.0 113.773 178.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -69.25 147.43 51.24 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.836 1.254 . . . . 0.0 112.345 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -143.01 148.2 36.37 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.247 1.419 . . . . 0.0 111.501 175.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 14.9 m -68.5 -26.29 65.39 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.826 1.417 . . . . 0.0 114.826 -175.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 89.6 mtt180 -78.22 -48.38 15.95 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.026 0.83 . . . . 0.0 112.055 -177.491 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -85.69 122.03 29.21 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.477 1.111 . . . . 0.0 111.966 -169.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -140.32 140.55 35.65 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.967 1.307 . . . . 0.0 110.539 -173.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.5 t -126.52 130.87 71.77 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 124.922 1.289 . . . . 0.0 110.01 -177.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 89.7 m -130.17 127.99 40.84 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.933 1.293 . . . . 0.0 110.427 -179.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -79.97 140.11 36.76 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.114 0.965 . . . . 0.0 110.997 173.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 27.1 mt -97.63 159.32 31.33 Favored Pre-proline 0 CA--C 1.546 0.827 0 C-N-CA 125.056 1.342 . . . . 0.0 111.487 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -67.0 -3.68 10.11 Favored 'Trans proline' 0 CA--C 1.543 0.944 0 C-N-CA 123.681 2.921 . . . . 0.0 114.351 175.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -69.05 -8.86 49.06 Favored 'General case' 0 CA--C 1.557 1.243 0 CA-C-N 119.364 0.983 . . . . 0.0 113.277 172.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 90.01 -34.08 4.23 Favored Glycine 0 N--CA 1.476 1.351 0 C-N-CA 126.439 1.971 . . . . 0.0 115.971 168.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 78.9 mtt85 -140.06 73.61 1.43 Allowed 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.862 1.265 . . . . 0.0 109.11 169.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -165.79 136.06 3.54 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 125.649 1.58 . . . . 0.0 108.577 -171.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -146.89 131.46 17.77 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.96 0.904 . . . . 0.0 111.734 -167.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 5.0 m-70 -94.53 133.87 37.69 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.743 0.817 . . . . 0.0 110.7 169.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 32.1 mtt -123.44 105.31 9.69 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 126.387 1.875 . . . . 0.0 109.242 -174.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 7.2 t -112.83 128.91 56.57 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -169.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 15.2 t -92.86 90.09 2.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 106.588 -1.634 . . . . 0.0 106.588 168.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 72.5 t -64.84 131.34 30.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 123.451 0.7 . . . . 0.0 109.236 177.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 3.5 tpp180 62.81 45.78 5.5 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.786 1.235 . . . . 0.0 112.136 173.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.33 138.12 58.42 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.583 -0.698 . . . . 0.0 112.724 -169.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 51.8 mmm-85 -116.42 163.76 15.57 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 126.178 1.791 . . . . 0.0 110.39 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 33.2 mtm105 -55.39 -25.42 35.5 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 179.339 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -71.72 -18.82 62.12 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 174.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -79.72 -27.37 40.62 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 119.736 1.153 . . . . 0.0 112.329 177.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 50.8 m -49.47 139.79 11.53 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.822 1.249 . . . . 0.0 113.152 179.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 147.22 -167.15 28.47 Favored Glycine 0 N--CA 1.472 1.055 0 C-N-CA 124.535 1.064 . . . . 0.0 113.089 -174.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.7 m -91.93 148.17 22.41 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.996 1.318 . . . . 0.0 110.833 -177.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 65.7 m-85 -147.41 157.95 43.78 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.907 1.683 . . . . 0.0 112.083 -174.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -158.4 159.27 35.58 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.993 1.317 . . . . 0.0 113.492 175.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 49.7 t -104.03 148.6 26.03 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.257 1.823 . . . . 0.0 111.255 178.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -151.77 136.44 5.48 Favored Glycine 0 N--CA 1.474 1.179 0 C-N-CA 123.743 0.687 . . . . 0.0 114.308 177.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -113.84 155.68 25.27 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.74 1.216 . . . . 0.0 113.046 -176.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 18.5 tt -146.51 132.79 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 125.316 1.446 . . . . 0.0 110.436 172.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 16.4 m -72.46 161.13 31.23 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.529 1.131 . . . . 0.0 112.954 -178.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.58 -10.13 49.09 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 115.946 1.832 . . . . 0.0 115.946 -178.515 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -71.52 147.55 92.53 Favored Pre-proline 0 CA--C 1.549 0.926 0 C-N-CA 124.241 1.016 . . . . 0.0 112.303 -178.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -67.57 -21.89 45.34 Favored 'Trans proline' 0 CA--C 1.538 0.725 0 C-N-CA 122.982 2.455 . . . . 0.0 112.807 177.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -85.99 -0.82 56.45 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 124.874 1.269 . . . . 0.0 113.893 176.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.9 157.17 31.33 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.245 1.018 . . . . 0.0 113.094 -177.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 84.6 mt-30 -138.0 158.62 43.96 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.118 1.767 . . . . 0.0 108.916 175.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 57.9 mt -78.23 118.27 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 121.745 -0.597 . . . . 0.0 110.578 -175.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 3.8 ttmp? -94.19 131.43 39.76 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.272 1.429 . . . . 0.0 109.12 169.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -114.51 149.74 35.94 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.18 0.992 . . . . 0.0 112.504 -170.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 51.7 m -88.37 164.97 15.27 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.295 1.438 . . . . 0.0 113.132 174.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -66.7 139.52 57.84 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.566 0.746 . . . . 0.0 109.408 168.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.55 166.62 23.29 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 -173.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -142.28 169.6 17.27 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 127.227 2.211 . . . . 0.0 110.668 172.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -116.74 144.69 44.15 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 174.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 66.9 tp -102.67 135.91 43.44 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 127.141 2.176 . . . . 0.0 109.224 169.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 35.3 ttm180 -131.6 108.54 9.6 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.339 1.456 . . . . 0.0 109.503 -179.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 35.9 t -99.82 115.22 40.35 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 124.198 0.999 . . . . 0.0 109.064 176.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 82.8 p -97.03 154.88 17.05 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.891 1.676 . . . . 0.0 110.664 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -63.09 142.49 58.36 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.304 0.642 . . . . 0.0 112.455 -176.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 48.7 ttt85 -77.93 102.08 7.15 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 123.87 0.868 . . . . 0.0 110.826 -179.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.93 147.87 49.11 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.462 1.105 . . . . 0.0 112.79 -179.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -68.98 151.77 46.11 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.8 0.84 . . . . 0.0 112.351 174.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 . . . . . 0 C--O 1.253 1.284 0 C-N-CA 124.978 1.311 . . . . 0.0 113.201 177.868 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 1.7 mpt? . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 116.657 -1.64 . . . . 0.0 111.395 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -68.62 152.77 74.42 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 CA-C-N 122.247 1.838 . . . . 0.0 110.643 172.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -60.91 138.81 81.38 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 123.051 2.5 . . . . 0.0 114.986 -175.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.1 t -162.56 141.39 8.93 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 125.587 1.555 . . . . 0.0 111.055 169.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -120.7 114.27 21.42 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 126.079 1.752 . . . . 0.0 106.819 171.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 67.6 m -130.94 151.99 79.89 Favored Pre-proline 0 N--CA 1.475 0.811 0 N-CA-C 114.144 1.165 . . . . 0.0 114.144 -169.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -68.55 152.52 89.0 Favored 'Cis proline' 0 C--N 1.353 0.779 0 CA-C-N 118.79 0.604 . . . . 0.0 111.257 -4.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -55.94 -28.63 57.76 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 176.394 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 45.1 tp -137.16 114.46 10.88 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.46 1.504 . . . . 0.0 108.302 168.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 44.7 tp -96.74 126.62 42.03 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.96 1.304 . . . . 0.0 109.187 173.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.7 t -111.77 122.84 66.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 124.142 0.977 . . . . 0.0 108.472 172.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 33.6 m -126.54 167.98 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 124.347 1.059 . . . . 0.0 111.997 174.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 22.7 m -91.12 146.64 23.67 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.779 1.232 . . . . 0.0 110.128 172.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -52.41 120.15 5.25 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.469 1.108 . . . . 0.0 111.78 174.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 97.86 -1.58 59.71 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 126.083 1.801 . . . . 0.0 114.804 -177.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -89.62 155.06 19.49 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 119.556 1.678 . . . . 0.0 112.556 178.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 66.8 m-20 -83.21 106.08 14.71 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.012 0.925 . . . . 0.0 110.182 177.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -89.66 111.9 22.99 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.841 0.856 . . . . 0.0 110.872 -176.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 33.8 m -120.08 125.53 48.51 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.961 0.904 . . . . 0.0 111.496 -175.289 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -96.98 146.92 24.51 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 126.05 1.74 . . . . 0.0 110.684 170.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 88.4 m -94.17 123.92 37.86 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.003 1.321 . . . . 0.0 108.081 169.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 37.2 t -122.74 122.6 39.13 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.878 1.671 . . . . 0.0 109.774 -176.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 42.4 t -143.74 127.5 17.2 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 121.45 -0.781 . . . . 0.0 111.067 -169.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 33.6 p90 -160.59 149.88 17.2 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.472 1.509 . . . . 0.0 111.653 169.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 64.9 m -83.47 153.18 24.59 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.928 0.891 . . . . 0.0 112.278 171.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -130.26 147.29 51.97 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.353 1.461 . . . . 0.0 110.959 173.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 24.6 p -85.28 -17.33 37.25 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.646 1.578 . . . . 0.0 113.747 -176.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 18.8 p -80.93 163.96 22.95 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.94 1.696 . . . . 0.0 112.828 176.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -79.1 -18.01 54.09 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.887 1.675 . . . . 0.0 113.597 -178.039 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 25.1 m -167.48 147.97 5.35 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 126.526 1.93 . . . . 0.0 110.945 177.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 32.5 p90 -158.6 160.63 36.77 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.568 1.147 . . . . 0.0 112.85 -169.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 91.4 t -96.19 134.22 34.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 C-N-CA 126.216 1.806 . . . . 0.0 108.616 169.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -100.39 128.31 46.49 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.246 1.019 . . . . 0.0 108.427 168.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 28.3 m120 -120.48 157.14 30.03 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.513 1.925 . . . . 0.0 111.423 -176.076 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 17.1 t90 -135.03 143.76 46.92 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.32 1.048 . . . . 0.0 112.821 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -141.4 148.51 39.69 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.907 1.283 . . . . 0.0 114.097 -169.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 59.1 ttt85 -104.45 143.21 33.32 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.453 1.501 . . . . 0.0 108.172 167.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 33.8 mtp -86.49 145.07 26.96 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.354 0.979 . . . . 0.0 112.388 174.356 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 74.1 m -107.4 152.19 41.19 Favored Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 125.612 1.565 . . . . 0.0 111.478 177.096 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -68.57 -17.35 43.23 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 124.102 3.201 . . . . 0.0 113.608 -175.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.3 m -76.92 9.09 3.14 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.849 1.26 . . . . 0.0 113.005 171.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 58.9 t30 69.63 46.51 0.71 Allowed 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 127.402 2.281 . . . . 0.0 111.901 178.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -137.72 -172.61 3.28 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.077 1.351 . . . . 0.0 110.922 176.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.2 p -138.05 151.05 47.48 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 125.847 1.659 . . . . 0.0 110.474 -172.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -127.76 131.8 49.62 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 124.878 1.271 . . . . 0.0 111.224 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -78.44 118.84 20.98 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.316 1.447 . . . . 0.0 111.404 -172.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 86.1 mt -97.41 -51.12 4.27 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.773 1.229 . . . . 0.0 112.278 -170.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -168.51 171.32 9.04 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.748 1.619 . . . . 0.0 109.858 -174.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.51 163.06 35.54 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.803 1.241 . . . . 0.0 111.351 -176.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 38.9 t80 -138.07 116.22 9.54 Favored Pre-proline 0 CA--C 1.546 0.818 0 C-N-CA 124.032 0.933 . . . . 0.0 110.543 169.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -61.92 163.24 43.19 Favored 'Cis proline' 0 CA--C 1.539 0.765 0 CA-C-N 119.286 0.781 . . . . 0.0 111.379 -8.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -68.78 94.51 0.61 Allowed 'General case' 0 CA--C 1.543 0.707 0 CA-C-O 122.756 1.265 . . . . 0.0 112.373 -173.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -90.6 9.12 30.86 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 127.72 2.408 . . . . 0.0 113.369 -176.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 52.2 ptt85 -69.35 -29.27 67.03 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.331 1.052 . . . . 0.0 113.182 172.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 43.4 m 68.05 -25.16 0.13 Allowed 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 128.106 2.562 . . . . 0.0 115.573 175.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 57.8 mm-40 -135.83 164.08 45.89 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 127.055 2.142 . . . . 0.0 110.369 -176.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -77.07 176.38 10.2 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 123.578 2.852 . . . . 0.0 111.365 169.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 123.04 -11.89 8.65 Favored Glycine 0 CA--C 1.533 1.194 0 C-N-CA 124.968 1.27 . . . . 0.0 114.79 176.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 11.9 mp0 -86.82 147.95 25.6 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 118.191 0.995 . . . . 0.0 109.682 169.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -76.59 148.55 36.93 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 123.712 0.805 . . . . 0.0 113.064 -175.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 17.4 m -59.66 -16.33 25.67 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.53 1.532 . . . . 0.0 114.848 -178.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 66.2 mtt85 -52.01 -48.68 64.35 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.998 1.319 . . . . 0.0 113.792 171.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -83.08 132.37 35.12 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 -165.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -143.82 141.31 30.31 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.384 1.474 . . . . 0.0 111.746 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 89.8 t -123.72 129.1 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 C-N-CA 125.552 1.541 . . . . 0.0 109.065 170.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 89.0 m -129.86 131.44 46.1 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.155 1.382 . . . . 0.0 110.074 -179.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -82.93 135.92 34.74 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.947 0.899 . . . . 0.0 110.359 173.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 33.2 mt -88.31 163.02 38.25 Favored Pre-proline 0 CA--C 1.547 0.842 0 C-N-CA 123.569 0.748 . . . . 0.0 111.987 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.74 -22.93 38.83 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 123.996 3.131 . . . . 0.0 114.009 170.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 58.5 t30 -65.14 -12.19 48.3 Favored 'General case' 0 CA--C 1.555 1.173 0 C-N-CA 124.26 1.024 . . . . 0.0 113.445 175.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 78.25 -34.11 1.76 Allowed Glycine 0 N--CA 1.476 1.351 0 C-N-CA 127.677 2.56 . . . . 0.0 116.352 168.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 2.5 ppt_? -130.13 73.47 1.53 Allowed 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 123.512 1.625 . . . . 0.0 108.32 171.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 11.1 t0 179.76 136.91 0.11 Allowed 'General case' 0 C--O 1.238 0.485 0 C-N-CA 128.515 2.726 . . . . 0.0 108.415 -169.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -145.85 148.51 32.95 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 124.222 1.009 . . . . 0.0 112.35 -168.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 14.2 m170 -105.68 123.59 48.17 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.079 1.352 . . . . 0.0 111.099 169.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -110.96 111.3 22.33 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 126.813 2.045 . . . . 0.0 108.01 -178.106 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 8.4 t -123.7 134.3 53.73 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 115.317 1.599 . . . . 0.0 115.317 -168.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 25.7 t -99.33 93.57 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 126.42 1.888 . . . . 0.0 106.153 167.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 98.0 t -66.9 127.23 28.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 124.882 1.273 . . . . 0.0 109.536 178.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 68.8 ttt180 57.65 55.68 5.4 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.767 1.627 . . . . 0.0 111.653 178.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -72.56 140.53 48.15 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.001 0.92 . . . . 0.0 112.616 -172.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 60.6 mtp85 -129.32 168.53 16.11 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.766 1.626 . . . . 0.0 110.26 -174.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 51.5 mtm180 -61.84 -17.58 56.88 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 115.598 1.703 . . . . 0.0 115.598 -169.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -71.37 -22.84 61.84 Favored 'General case' 0 CA--C 1.553 1.064 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 169.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 -86.55 -13.54 45.56 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 125.377 1.471 . . . . 0.0 113.574 -176.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 41.4 m -55.61 137.82 48.29 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 120.986 -1.071 . . . . 0.0 111.183 169.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 151.61 -165.98 30.65 Favored Glycine 0 N--CA 1.471 0.97 0 O-C-N 121.445 -0.785 . . . . 0.0 113.504 -176.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.9 m -98.5 140.83 32.16 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.879 1.272 . . . . 0.0 110.895 -172.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -140.26 154.12 46.75 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.084 1.354 . . . . 0.0 112.568 -175.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.3 pp -158.35 153.99 26.32 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.944 1.298 . . . . 0.0 112.778 179.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 14.4 m -95.47 159.91 14.77 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.604 0.761 . . . . 0.0 112.121 172.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -143.8 175.26 23.82 Favored Glycine 0 CA--C 1.527 0.823 0 C-N-CA 125.35 1.452 . . . . 0.0 111.56 168.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -158.54 159.24 35.33 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 118.635 1.217 . . . . 0.0 113.96 -178.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 16.9 tt -150.22 138.94 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 125.417 1.487 . . . . 0.0 110.564 177.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 13.5 m -69.51 159.67 32.88 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.321 1.048 . . . . 0.0 112.668 176.39 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 40.9 mt -75.17 -11.87 60.17 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 177.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -65.59 148.78 97.93 Favored Pre-proline 0 CA--C 1.552 1.029 0 C-N-CA 124.405 1.082 . . . . 0.0 112.367 175.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -69.47 -20.19 36.55 Favored 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 123.141 2.561 . . . . 0.0 113.194 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -87.23 3.64 45.75 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.715 1.206 . . . . 0.0 113.886 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -67.31 164.56 18.18 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.871 1.268 . . . . 0.0 113.957 -175.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 22.1 pt20 -149.1 163.5 37.4 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.417 1.887 . . . . 0.0 109.756 176.28 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 54.8 mt -83.83 135.78 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 CA-C-O 121.554 0.693 . . . . 0.0 112.744 -171.356 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -95.99 144.67 26.08 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 127.502 2.321 . . . . 0.0 109.74 167.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.9 mp0 -143.03 158.82 43.24 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 126.543 1.937 . . . . 0.0 109.801 170.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 4.1 t -150.08 -170.35 3.62 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 175.07 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -61.5 130.68 47.17 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.13 1.772 . . . . 0.0 114.109 -169.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.73 167.18 22.31 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 115.872 1.804 . . . . 0.0 115.872 -169.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -123.27 169.67 11.06 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 127.33 2.252 . . . . 0.0 110.812 169.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -126.64 143.97 51.06 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.994 1.318 . . . . 0.0 111.846 -177.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 49.8 tp -114.08 136.7 52.64 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 126.354 1.861 . . . . 0.0 110.293 173.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 59.6 ttt85 -127.49 123.37 35.78 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 126.171 1.788 . . . . 0.0 109.944 170.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 44.9 t -102.96 123.57 56.45 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 124.612 1.165 . . . . 0.0 108.679 169.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 79.6 p -99.77 158.64 15.64 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.744 1.618 . . . . 0.0 110.882 176.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -58.52 150.85 21.69 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.421 1.088 . . . . 0.0 112.894 -178.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 11.9 ttm180 -69.7 126.46 29.78 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 123.695 0.798 . . . . 0.0 109.982 -174.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 64.0 mtt-85 -77.15 155.5 32.27 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.188 0.995 . . . . 0.0 112.624 -168.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -70.25 154.36 42.0 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.497 1.119 . . . . 0.0 112.509 175.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 . . . . . 0 C--O 1.253 1.259 0 C-N-CA 125.224 1.41 . . . . 0.0 112.965 177.267 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . 0.587 ' N ' ' HG ' ' A' ' 57' ' ' SER . 27.8 ttt . . . . . 0 N--CA 1.488 1.437 0 CA-C-O 118.549 -0.739 . . . . 0.0 110.37 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -68.9 151.86 73.75 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 122.847 2.365 . . . . 0.0 111.216 177.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -68.48 123.27 10.32 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 123.469 2.779 . . . . 0.0 110.07 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 33.7 m -128.05 147.37 50.52 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.317 1.447 . . . . 0.0 109.661 -174.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -143.28 117.91 9.81 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.671 1.589 . . . . 0.0 109.043 179.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 88.6 p -140.94 159.89 60.36 Favored Pre-proline 0 CA--C 1.551 0.994 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 -168.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.3 162.51 79.31 Favored 'Cis proline' 0 C--N 1.356 0.925 0 CA-C-N 120.058 1.057 . . . . 0.0 111.912 -3.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.74 -24.05 67.61 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 177.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 47.9 tp -142.0 124.15 15.49 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 125.341 1.457 . . . . 0.0 108.658 169.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 53.7 tp -111.25 126.57 55.02 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.064 1.346 . . . . 0.0 109.255 171.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.2 t -111.51 122.57 66.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.966 0.907 . . . . 0.0 109.252 175.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.1 m -126.63 173.24 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 125.132 1.373 . . . . 0.0 111.342 170.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 99.1 m -104.84 151.79 23.4 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.49 1.516 . . . . 0.0 110.228 172.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -51.77 125.56 15.38 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.281 1.032 . . . . 0.0 112.562 174.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.84 -3.46 74.07 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 126.054 1.788 . . . . 0.0 114.531 -176.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -92.61 154.37 18.43 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 119.594 1.697 . . . . 0.0 111.523 175.033 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -85.17 127.39 34.25 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 121.505 0.669 . . . . 0.0 111.305 171.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -103.83 128.13 51.29 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.737 1.615 . . . . 0.0 110.083 178.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 27.7 m -128.66 127.87 43.02 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.064 0.945 . . . . 0.0 111.371 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -103.28 158.83 16.05 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.553 1.941 . . . . 0.0 110.59 170.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 85.5 m -101.2 134.21 44.59 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.058 1.343 . . . . 0.0 109.261 169.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 44.8 t -115.16 134.06 55.49 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.432 1.893 . . . . 0.0 110.011 170.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 66.8 m -138.69 130.34 27.63 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.194 0.997 . . . . 0.0 111.042 -173.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 40.9 p90 -160.6 153.01 20.59 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.494 1.518 . . . . 0.0 110.535 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.587 ' HG ' ' N ' ' A' ' 33' ' ' MET . 31.1 p -93.42 152.87 18.83 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.261 0.624 . . . . 0.0 111.042 168.58 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 -152.45 140.06 19.78 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.086 0.954 . . . . 0.0 111.625 -177.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 52.7 m -132.12 106.56 8.06 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.404 1.481 . . . . 0.0 108.145 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 29.6 t -177.26 169.73 2.23 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.422 1.889 . . . . 0.0 110.394 -172.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -76.52 -19.71 57.67 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 123.787 0.835 . . . . 0.0 112.061 168.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.8 m -175.52 163.5 2.96 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 127.538 2.335 . . . . 0.0 112.227 179.089 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 40.8 p90 -148.59 162.53 39.49 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.045 1.338 . . . . 0.0 111.924 -177.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 87.7 t -111.03 128.43 67.48 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 C-N-CA 125.612 1.565 . . . . 0.0 108.075 169.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 58.8 tp -106.37 134.05 50.11 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 125.243 1.417 . . . . 0.0 108.883 169.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -127.16 150.47 49.49 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.152 1.381 . . . . 0.0 110.825 178.033 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 11.7 t90 -117.62 139.99 50.24 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.473 1.109 . . . . 0.0 111.236 176.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -133.29 146.86 51.77 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.703 1.201 . . . . 0.0 113.626 -172.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -111.07 138.67 47.19 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.608 1.563 . . . . 0.0 108.276 168.042 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 28.3 mtp -85.05 143.62 28.77 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 118.846 0.748 . . . . 0.0 112.339 -178.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.4 m -100.43 154.05 37.41 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 125.212 1.405 . . . . 0.0 111.918 178.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.83 -30.98 79.17 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 124.442 3.428 . . . . 0.0 114.704 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.0 m -77.0 10.74 2.13 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.079 1.352 . . . . 0.0 113.593 178.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 66.38 43.6 2.63 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.775 2.03 . . . . 0.0 111.353 -176.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 -121.55 -172.73 2.48 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.551 1.541 . . . . 0.0 109.88 175.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.1 p -144.74 144.23 31.09 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.638 1.575 . . . . 0.0 110.609 -173.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -121.54 132.43 54.7 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.721 1.208 . . . . 0.0 111.347 176.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -77.66 128.27 33.82 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.866 1.266 . . . . 0.0 111.335 -177.334 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 60.0 mt -104.7 -44.5 4.85 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.196 1.398 . . . . 0.0 113.544 -168.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -171.27 174.93 4.38 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 128.085 2.554 . . . . 0.0 109.395 -174.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.6 166.57 30.45 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.314 1.046 . . . . 0.0 112.769 -170.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -142.89 115.25 6.03 Favored Pre-proline 0 CA--C 1.546 0.821 0 C-N-CA 125.435 1.494 . . . . 0.0 109.67 169.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -55.12 153.4 20.94 Favored 'Cis proline' 0 C--N 1.351 0.705 0 CA-C-N 119.941 1.015 . . . . 0.0 112.665 -10.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -67.63 118.59 11.12 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 123.426 0.691 . . . . 0.0 112.387 -175.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -94.48 19.24 9.96 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 126.475 1.91 . . . . 0.0 112.176 178.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 78.6 mtp180 -57.66 -7.87 0.77 Allowed 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 127.205 2.202 . . . . 0.0 116.616 -168.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 21.3 m -67.03 -22.13 65.89 Favored 'General case' 0 CA--C 1.546 0.801 0 O-C-N 121.068 -1.02 . . . . 0.0 112.691 168.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 64.5 mm-40 -88.74 143.12 31.31 Favored Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 124.454 1.102 . . . . 0.0 111.432 176.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -76.15 159.56 37.07 Favored 'Trans proline' 0 C--N 1.35 0.655 0 C-N-CA 123.756 2.971 . . . . 0.0 113.089 -171.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 101.52 -20.71 45.49 Favored Glycine 0 N--CA 1.471 1.017 0 C-N-CA 126.126 1.822 . . . . 0.0 112.062 -179.019 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -81.27 149.28 29.05 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.911 1.284 . . . . 0.0 111.204 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -142.93 144.51 32.43 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.818 1.247 . . . . 0.0 111.477 -169.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 56.0 p -67.91 -14.93 63.36 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 115.027 1.491 . . . . 0.0 115.027 -174.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 13.0 ptp180 -65.26 -24.65 67.38 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 119.305 0.957 . . . . 0.0 112.725 173.176 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -93.99 140.02 30.22 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.32 1.448 . . . . 0.0 111.339 -176.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -137.86 145.27 41.99 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.298 1.439 . . . . 0.0 111.123 178.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 58.1 t -126.54 125.23 66.87 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 125.538 1.535 . . . . 0.0 108.734 174.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 84.8 m -130.49 129.28 42.72 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.818 1.247 . . . . 0.0 110.655 -174.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.7 pm0 -76.61 141.32 41.1 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.792 1.237 . . . . 0.0 111.605 175.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 38.0 mt -93.92 157.82 37.34 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 123.829 0.852 . . . . 0.0 111.628 177.061 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -65.71 -3.56 8.24 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 123.551 2.834 . . . . 0.0 114.028 174.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -62.41 -26.14 68.33 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 119.441 1.018 . . . . 0.0 112.739 169.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 92.34 -15.7 61.6 Favored Glycine 0 N--CA 1.474 1.226 0 C-N-CA 125.659 1.599 . . . . 0.0 114.547 175.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.41 73.51 0.91 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.769 1.628 . . . . 0.0 109.995 170.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -174.64 147.43 1.06 Allowed 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 127.223 2.209 . . . . 0.0 109.054 -177.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 60.6 m-85 -143.62 151.29 39.96 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 114.103 1.149 . . . . 0.0 114.103 -168.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 13.5 m170 -110.01 139.32 45.25 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.684 1.594 . . . . 0.0 109.625 167.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 46.1 mtt -128.84 123.73 33.53 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.896 1.278 . . . . 0.0 109.212 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 88.9 p -130.48 139.12 50.54 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 115.739 1.755 . . . . 0.0 115.739 -168.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 15.5 t -98.11 104.02 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 125.922 1.689 . . . . 0.0 106.656 169.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 60.7 t -81.48 128.67 38.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 123.647 0.779 . . . . 0.0 109.868 -176.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 50.1 ttt85 56.23 53.62 8.7 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.224 1.41 . . . . 0.0 111.017 178.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.43 145.83 55.64 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.614 1.166 . . . . 0.0 112.106 -170.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 33.8 mmm-85 -118.92 168.05 11.15 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.884 1.674 . . . . 0.0 110.489 178.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 44.3 mtm180 -57.78 -20.54 36.08 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 120.862 -1.149 . . . . 0.0 113.738 173.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -59.57 -22.86 62.34 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.248 1.419 . . . . 0.0 113.893 168.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -94.92 -13.28 25.54 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.214 1.406 . . . . 0.0 114.435 -175.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 67.2 m -60.71 134.89 57.53 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-N 120.349 1.431 . . . . 0.0 112.616 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 155.92 -165.78 32.76 Favored Glycine 0 N--CA 1.473 1.139 0 O-C-N 121.247 -0.908 . . . . 0.0 113.571 -177.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.0 m -95.98 139.61 31.93 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.501 1.12 . . . . 0.0 110.747 -177.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 61.3 m-85 -137.41 156.39 48.25 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.074 1.75 . . . . 0.0 112.558 -176.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -161.96 147.85 13.39 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.797 1.639 . . . . 0.0 112.134 176.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 24.7 p -94.46 159.16 15.23 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.698 0.799 . . . . 0.0 112.655 169.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -148.07 131.48 3.84 Favored Glycine 0 CA--C 1.529 0.91 0 C-N-CA 124.766 1.174 . . . . 0.0 112.639 173.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -115.11 147.41 40.26 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.563 1.145 . . . . 0.0 112.634 -176.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 18.6 tt -148.14 136.38 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 125.189 1.396 . . . . 0.0 111.007 178.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 31.5 m -72.15 155.38 40.32 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 121.101 -0.999 . . . . 0.0 111.853 174.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.68 -10.78 58.34 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 115.775 1.769 . . . . 0.0 115.775 -174.708 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -75.27 140.63 73.0 Favored Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 124.137 0.975 . . . . 0.0 111.935 179.262 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -55.28 -23.43 37.39 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 123.875 3.05 . . . . 0.0 114.797 174.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -71.2 -13.91 62.08 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 124.968 1.307 . . . . 0.0 114.099 177.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -74.73 161.47 29.6 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.24 1.416 . . . . 0.0 113.839 -176.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 28.5 mp0 -132.41 156.99 45.68 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.379 1.872 . . . . 0.0 108.573 170.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 33.7 mt -75.91 116.38 18.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 O-C-N 121.731 -0.606 . . . . 0.0 109.98 178.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.3 88.47 4.94 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.026 0.93 . . . . 0.0 109.358 169.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -77.38 131.32 37.99 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.466 1.106 . . . . 0.0 110.911 179.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 76.8 p -81.42 166.91 19.97 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 115.333 1.605 . . . . 0.0 115.333 -174.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 10.1 mp -67.29 114.5 6.05 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.103 0.961 . . . . 0.0 109.271 171.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.06 150.89 44.44 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -173.025 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -131.83 169.65 15.95 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 126.422 1.889 . . . . 0.0 112.442 178.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -110.89 139.66 46.03 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.078 1.351 . . . . 0.0 112.333 -177.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 59.6 tp -109.0 128.02 54.58 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 126.063 1.745 . . . . 0.0 108.938 168.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -118.77 117.01 27.74 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.494 1.518 . . . . 0.0 109.53 173.185 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 34.9 t -102.58 117.83 48.55 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 C-N-CA 124.347 1.059 . . . . 0.0 108.563 169.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 81.6 p -95.96 156.95 16.12 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.895 1.678 . . . . 0.0 111.304 -178.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -59.05 142.32 51.65 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.45 1.1 . . . . 0.0 113.224 -171.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -67.42 118.12 10.32 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 172.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 32.7 ptt-85 -139.78 167.61 21.71 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.418 1.087 . . . . 0.0 112.638 -168.145 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -72.75 154.31 40.73 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.526 1.13 . . . . 0.0 112.433 175.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 . . . . . 0 C--O 1.254 1.327 0 C-N-CA 125.224 1.41 . . . . 0.0 113.001 177.1 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 10.7 tpt . . . . . 0 N--CA 1.488 1.463 0 CA-C-O 117.822 -1.085 . . . . 0.0 110.06 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -59.39 -49.59 10.31 Favored 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 123.339 2.693 . . . . 0.0 115.068 -177.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -79.69 162.37 24.35 Favored 'Trans proline' 0 C--N 1.355 0.918 0 C-N-CA 122.37 2.047 . . . . 0.0 111.881 170.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 6.4 t -154.73 163.23 40.56 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.091 0.957 . . . . 0.0 112.206 173.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -148.07 116.74 6.66 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.997 2.119 . . . . 0.0 109.232 -175.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 73.0 m -140.82 160.65 57.77 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 124.621 1.168 . . . . 0.0 113.17 -169.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -71.53 156.34 97.09 Favored 'Cis proline' 0 C--N 1.352 0.75 0 CA-C-N 119.535 0.87 . . . . 0.0 111.305 -5.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.44 -20.09 64.16 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 176.029 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 36.2 tp -141.9 120.16 12.25 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.642 1.577 . . . . 0.0 108.874 169.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 62.1 tp -109.92 122.36 47.36 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.156 1.382 . . . . 0.0 108.98 169.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.2 t -106.25 123.8 61.2 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 172.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.5 m -128.05 176.23 8.1 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 124.828 1.251 . . . . 0.0 111.092 171.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 52.7 m -110.12 151.5 27.16 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.605 1.562 . . . . 0.0 110.519 175.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -54.33 125.16 18.26 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.906 1.282 . . . . 0.0 112.201 178.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 97.3 -9.16 64.97 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 127.224 2.345 . . . . 0.0 114.301 -174.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -81.38 160.53 24.07 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 119.927 1.863 . . . . 0.0 112.547 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -91.88 111.34 22.84 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.473 1.109 . . . . 0.0 109.302 172.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -96.52 118.64 33.45 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.098 0.959 . . . . 0.0 111.143 -175.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 28.5 m -123.08 125.26 44.86 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.566 0.746 . . . . 0.0 112.13 -173.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -101.76 159.55 15.23 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.909 1.683 . . . . 0.0 110.755 169.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 21.0 m -110.67 128.91 55.89 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.179 1.392 . . . . 0.0 110.037 174.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 42.5 t -115.06 150.89 35.2 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.916 1.687 . . . . 0.0 111.67 171.407 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 62.0 p -148.28 143.86 27.23 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.254 -0.904 . . . . 0.0 111.362 169.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.438 ' CD2' ' HB3' ' A' ' 125' ' ' ALA . 3.3 m-85 -130.84 156.2 45.42 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 126.251 1.82 . . . . 0.0 114.677 -176.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.6 t -133.9 133.63 41.7 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.486 1.515 . . . . 0.0 108.671 168.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -133.88 151.87 51.67 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.042 1.337 . . . . 0.0 111.664 -171.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 16.6 m -72.01 -34.92 69.24 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.439 1.496 . . . . 0.0 112.95 -173.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 5.3 t -97.64 -171.15 2.12 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.003 0.921 . . . . 0.0 113.234 -178.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -71.02 -20.3 62.41 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.638 1.575 . . . . 0.0 115.083 -168.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 8.5 t -167.14 173.5 9.05 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.375 1.47 . . . . 0.0 111.345 -175.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 55.0 p90 -159.51 154.74 25.25 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.783 1.233 . . . . 0.0 113.204 -175.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 75.9 t -96.12 133.72 36.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 C-N-CA 125.636 1.574 . . . . 0.0 107.302 168.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.451 HD22 ' CG ' ' A' ' 106' ' ' PHE . 5.5 tp -99.3 147.6 25.02 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.714 1.206 . . . . 0.0 110.123 174.143 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 23.0 m120 -136.21 154.3 50.97 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.745 1.618 . . . . 0.0 111.382 -176.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 12.6 t90 -129.84 137.9 50.7 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.425 1.09 . . . . 0.0 111.787 177.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -134.02 145.73 49.72 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 -174.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 56.7 ttt85 -101.92 142.03 33.85 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.26 1.424 . . . . 0.0 107.883 166.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 29.6 mtp -88.25 144.34 26.5 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 118.657 0.662 . . . . 0.0 112.54 175.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 74.3 m -106.45 149.47 38.35 Favored Pre-proline 0 CA--C 1.545 0.755 0 C-N-CA 125.43 1.492 . . . . 0.0 111.161 173.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -68.37 -15.86 42.73 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 124.016 3.144 . . . . 0.0 114.013 -173.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 18.4 m -76.94 8.96 3.24 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.813 1.245 . . . . 0.0 113.027 172.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 58.1 t30 70.53 45.75 0.59 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 127.693 2.397 . . . . 0.0 111.507 -177.555 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -128.93 -179.53 5.15 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.56 1.544 . . . . 0.0 110.368 -179.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.7 p -142.2 152.52 43.21 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 126.02 1.728 . . . . 0.0 110.503 -175.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -131.05 131.89 44.57 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.515 1.126 . . . . 0.0 111.177 174.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -77.69 121.23 23.72 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.473 1.109 . . . . 0.0 110.89 -178.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 48.0 mt -94.27 -45.01 7.69 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.476 1.51 . . . . 0.0 111.82 -173.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -168.35 175.64 6.29 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.497 1.919 . . . . 0.0 110.565 -171.059 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -158.41 165.8 33.78 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.435 1.494 . . . . 0.0 111.57 -175.319 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -153.06 117.11 2.82 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 124.233 1.013 . . . . 0.0 111.39 172.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.75 154.33 23.49 Favored 'Cis proline' 0 C--N 1.35 0.63 0 CA-C-N 119.665 0.916 . . . . 0.0 111.981 -12.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -72.59 94.65 1.73 Allowed 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 121.841 0.829 . . . . 0.0 111.091 178.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -78.58 -2.0 36.78 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.816 1.646 . . . . 0.0 114.249 -177.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.8 ptm180 -75.51 5.35 6.02 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.65 1.98 . . . . 0.0 115.082 -177.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.7 t 81.9 -42.45 0.15 Allowed 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 128.446 2.698 . . . . 0.0 113.134 175.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -109.33 109.51 60.33 Favored Pre-proline 0 CA--C 1.545 0.782 0 C-N-CA 124.781 1.233 . . . . 0.0 109.972 176.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -88.63 140.3 4.28 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 123.767 2.978 . . . . 0.0 111.754 -173.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 85.08 16.26 65.35 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 125.135 1.35 . . . . 0.0 113.257 170.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -71.48 -34.54 70.27 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 117.781 0.79 . . . . 0.0 113.043 -169.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -93.89 131.46 39.29 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.697 1.199 . . . . 0.0 110.914 172.431 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 54.2 p -90.57 -16.69 28.29 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 114.497 1.295 . . . . 0.0 114.497 -176.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 35.2 mtp-105 -97.07 -44.64 6.89 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.329 1.051 . . . . 0.0 113.187 -169.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 99.6 m-85 -97.52 116.25 29.37 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.856 1.263 . . . . 0.0 109.908 -178.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -130.37 141.25 50.57 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.714 1.205 . . . . 0.0 111.332 -172.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 47.5 t -126.53 125.93 68.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 C-N-CA 125.085 1.354 . . . . 0.0 109.706 178.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 87.3 m -130.54 131.29 44.98 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.925 1.29 . . . . 0.0 110.674 -176.327 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -79.66 140.76 36.94 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.923 0.889 . . . . 0.0 111.91 176.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 27.1 mt -95.1 157.1 37.05 Favored Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 125.586 1.554 . . . . 0.0 111.67 178.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -70.76 -2.76 11.41 Favored 'Trans proline' 0 CA--C 1.542 0.915 0 C-N-CA 123.619 2.88 . . . . 0.0 114.177 175.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -70.24 -8.95 54.17 Favored 'General case' 0 CA--C 1.555 1.141 0 N-CA-C 114.109 1.152 . . . . 0.0 114.109 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 108.03 -33.95 5.94 Favored Glycine 0 N--CA 1.476 1.336 0 C-N-CA 125.903 1.716 . . . . 0.0 116.443 168.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.49 73.28 0.9 Allowed 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.453 1.627 . . . . 0.0 110.224 169.599 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -157.45 142.37 16.79 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 125.171 1.389 . . . . 0.0 109.34 -167.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . 0.451 ' CG ' HD22 ' A' ' 65' ' ' LEU . 31.3 m-85 -149.45 135.17 18.65 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.056 0.542 . . . . 0.0 111.724 -169.089 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -90.99 136.25 33.2 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.022 0.929 . . . . 0.0 111.129 169.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 32.9 mtt -121.22 106.03 11.12 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 126.063 1.745 . . . . 0.0 109.38 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 33.8 t -110.98 128.88 55.98 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.257 1.023 . . . . 0.0 113.416 -169.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 28.2 t -96.88 100.85 11.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 C-N-CA 125.865 1.666 . . . . 0.0 106.61 168.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 89.0 t -73.96 129.23 36.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 124.09 0.956 . . . . 0.0 109.924 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 60.57 57.02 2.88 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.137 1.375 . . . . 0.0 110.967 173.577 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.78 156.31 39.46 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.338 1.055 . . . . 0.0 113.211 -171.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 23.6 mtm180 -133.66 160.68 36.81 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 126.533 1.933 . . . . 0.0 109.716 -168.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 32.2 mtp85 -55.65 -27.49 50.15 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 120.03 1.286 . . . . 0.0 113.258 171.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -69.89 -20.67 63.37 Favored 'General case' 0 CA--C 1.553 1.084 0 N-CA-C 114.476 1.287 . . . . 0.0 114.476 172.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -83.24 -9.81 58.92 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 121.061 -1.024 . . . . 0.0 112.879 175.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 71.2 m -59.88 135.6 57.75 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 120.211 -1.555 . . . . 0.0 111.634 173.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 160.27 -172.75 36.77 Favored Glycine 0 CA--C 1.53 1.028 0 C-N-CA 124.529 1.062 . . . . 0.0 113.365 -179.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.0 m -91.13 140.92 29.36 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.802 0.841 . . . . 0.0 109.985 176.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 52.9 m-85 -133.82 160.17 38.44 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.232 1.813 . . . . 0.0 110.632 178.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -155.99 149.54 24.85 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 124.299 1.04 . . . . 0.0 112.684 175.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 36.7 t -89.57 158.64 17.56 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.149 1.38 . . . . 0.0 111.054 173.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -149.32 170.43 29.59 Favored Glycine 0 N--CA 1.471 1.026 0 C-N-CA 125.634 1.587 . . . . 0.0 112.282 174.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . 0.438 ' HB3' ' CD2' ' A' ' 56' ' ' PHE . . . -156.68 159.21 38.17 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 173.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 21.0 tt -140.8 135.6 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 125.846 1.658 . . . . 0.0 109.934 174.253 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 19.9 m -69.31 160.79 30.59 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.515 0.726 . . . . 0.0 112.821 -179.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.53 -15.88 63.73 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 115.421 1.637 . . . . 0.0 115.421 -173.518 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -78.68 149.09 74.06 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 124.776 1.23 . . . . 0.0 112.445 -177.253 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -67.68 -22.48 43.73 Favored 'Trans proline' 0 CA--C 1.54 0.775 0 C-N-CA 123.125 2.55 . . . . 0.0 113.09 -179.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -79.19 -2.95 43.34 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 114.687 1.365 . . . . 0.0 114.687 176.199 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.46 167.71 16.07 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.769 1.228 . . . . 0.0 113.319 -178.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 22.3 pt20 -146.8 161.3 40.96 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.207 1.803 . . . . 0.0 109.312 173.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 20.9 mt -77.65 118.9 25.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 O-C-N 121.609 -0.682 . . . . 0.0 111.126 -174.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -89.76 128.14 36.07 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.313 1.445 . . . . 0.0 109.426 168.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -87.12 145.39 26.46 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.347 1.059 . . . . 0.0 110.861 178.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 5.8 t -94.36 -166.8 1.55 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.44 1.096 . . . . 0.0 112.237 172.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -68.02 153.01 44.64 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.33 1.452 . . . . 0.0 111.676 174.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 25.7 mtp-105 -91.15 146.51 23.77 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 125.346 1.458 . . . . 0.0 110.906 172.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -143.0 150.03 39.09 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.269 1.427 . . . . 0.0 111.837 178.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -93.0 132.49 37.04 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.599 1.16 . . . . 0.0 111.818 177.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 48.1 tp -103.63 126.33 50.71 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 166.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 33.6 ttm180 -128.38 109.94 11.89 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 124.342 1.057 . . . . 0.0 109.01 -178.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 21.8 t -102.32 119.53 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 123.872 0.869 . . . . 0.0 108.727 178.041 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 70.1 p -93.36 147.72 22.68 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 126.064 1.746 . . . . 0.0 109.887 178.12 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 10.6 pm0 -57.43 150.23 19.02 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.741 0.817 . . . . 0.0 112.592 -179.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 47.2 ttt85 -64.93 116.55 6.49 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 124.079 0.952 . . . . 0.0 110.918 -168.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 18.6 ptp180 -71.09 157.73 37.69 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.995 0.918 . . . . 0.0 113.37 -169.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -70.71 154.36 41.93 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.346 1.058 . . . . 0.0 112.367 174.238 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 . . . . . 0 C--O 1.252 1.196 0 C-N-CA 125.07 1.348 . . . . 0.0 113.314 177.772 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 97.0 mmm . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 118.354 -0.831 . . . . 0.0 110.762 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_exo -58.4 -46.38 24.92 Favored 'Trans proline' 0 CA--C 1.545 1.027 0 C-N-CA 123.688 2.925 . . . . 0.0 116.137 -177.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -81.69 160.26 19.09 Favored 'Trans proline' 0 C--N 1.356 0.966 0 C-N-CA 122.374 2.05 . . . . 0.0 112.158 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.2 t -158.58 158.13 33.31 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.359 1.063 . . . . 0.0 112.126 176.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -144.97 115.31 7.56 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 126.415 1.886 . . . . 0.0 108.493 175.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 93.3 p -140.88 159.31 62.72 Favored Pre-proline 0 CA--C 1.55 0.954 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 -168.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -69.84 161.6 86.1 Favored 'Cis proline' 0 C--N 1.354 0.867 0 CA-C-N 119.488 0.853 . . . . 0.0 111.6 -6.088 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.68 -24.49 67.8 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.148 0.795 . . . . 0.0 113.148 176.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 46.4 tp -141.0 121.26 13.89 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.639 1.576 . . . . 0.0 108.784 169.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 57.0 tp -107.17 125.45 51.11 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.241 1.417 . . . . 0.0 109.078 171.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.4 t -109.61 123.54 65.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.089 0.956 . . . . 0.0 108.702 173.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 26.8 m -127.42 164.38 28.53 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 124.707 1.203 . . . . 0.0 111.451 172.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 51.9 m -90.66 149.43 22.09 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.272 1.029 . . . . 0.0 110.451 171.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -56.98 123.66 15.93 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.117 0.967 . . . . 0.0 111.834 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 87.92 3.53 79.83 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 126.106 1.812 . . . . 0.0 114.569 -175.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -92.27 157.6 16.57 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.487 1.644 . . . . 0.0 111.569 170.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -82.45 130.37 35.09 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.187 0.995 . . . . 0.0 110.635 177.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -112.9 124.72 53.25 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.787 1.235 . . . . 0.0 111.099 -178.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 28.4 m -129.76 125.4 35.75 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 119.184 0.902 . . . . 0.0 112.078 -176.437 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -100.41 151.26 21.74 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.697 1.599 . . . . 0.0 110.621 169.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 58.0 m -99.54 130.39 45.78 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.292 1.437 . . . . 0.0 109.112 173.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 44.5 t -125.06 143.51 50.88 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 126.242 1.817 . . . . 0.0 111.496 177.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 96.3 p -153.97 156.82 38.16 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.103 -0.998 . . . . 0.0 113.131 168.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -143.39 156.19 44.61 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.846 2.058 . . . . 0.0 111.25 178.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.6 t -84.6 101.44 12.13 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 166.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -124.8 145.36 49.79 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.483 1.513 . . . . 0.0 110.77 -177.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 24.0 m -57.17 139.26 53.11 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.66 1.584 . . . . 0.0 110.724 179.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.2 m -68.75 -2.23 8.85 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 115.184 1.55 . . . . 0.0 115.184 -172.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -78.2 -70.74 0.47 Allowed 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.179 1.392 . . . . 0.0 111.428 -178.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 82.2 p -171.38 150.64 2.91 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.515 1.126 . . . . 0.0 113.631 -176.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 34.7 p90 -169.11 164.36 11.22 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.191 1.796 . . . . 0.0 111.84 -176.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 21.4 t -107.83 134.1 50.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 125.848 1.659 . . . . 0.0 109.027 169.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -104.53 141.08 37.02 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.648 1.179 . . . . 0.0 109.282 168.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -137.7 158.04 45.2 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.471 1.508 . . . . 0.0 111.182 -170.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 10.0 t90 -129.09 138.02 51.59 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.417 1.087 . . . . 0.0 112.187 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -131.19 141.41 50.05 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.247 1.419 . . . . 0.0 112.977 -175.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 48.7 ttp180 -101.11 143.98 30.56 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.936 2.094 . . . . 0.0 108.718 169.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 36.8 mtp -93.65 141.86 28.0 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.854 0.752 . . . . 0.0 112.398 178.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.0 m -92.21 158.49 39.06 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 124.849 1.26 . . . . 0.0 111.709 175.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_exo -55.81 -33.44 88.2 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 123.949 3.099 . . . . 0.0 114.192 177.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 12.6 m -77.03 8.28 4.03 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.201 1.4 . . . . 0.0 113.821 177.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 60.3 t30 70.19 22.84 5.38 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 127.279 2.232 . . . . 0.0 113.259 -178.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 45.4 mt-30 -90.14 -176.73 4.95 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.423 1.089 . . . . 0.0 110.364 169.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.6 p -138.3 152.18 48.28 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.515 1.526 . . . . 0.0 111.165 -175.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -132.58 129.33 38.86 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 126.505 1.922 . . . . 0.0 110.155 -176.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 44.9 tttm -85.76 121.5 28.51 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.194 0.998 . . . . 0.0 111.252 -171.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 53.5 mt -97.6 -48.69 5.15 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.914 1.285 . . . . 0.0 113.124 -168.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -170.66 172.68 5.71 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.88 1.672 . . . . 0.0 110.972 -172.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.59 165.49 32.7 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.993 1.317 . . . . 0.0 112.629 -177.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -140.63 121.0 8.86 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 125.684 1.594 . . . . 0.0 109.822 170.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.23 154.16 17.59 Favored 'Cis proline' 0 C--N 1.351 0.694 0 CA-C-N 120.065 1.059 . . . . 0.0 112.96 -9.404 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -65.55 111.8 3.3 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.954 0.883 . . . . 0.0 112.739 -171.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -89.53 7.41 36.39 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.723 2.009 . . . . 0.0 112.882 177.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -55.54 -11.2 0.81 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 126.993 2.117 . . . . 0.0 116.458 -170.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 20.3 m -62.46 -25.22 67.87 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.628 1.171 . . . . 0.0 112.649 168.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -83.71 123.15 76.54 Favored Pre-proline 0 CA--C 1.549 0.923 0 CA-C-O 118.173 -0.918 . . . . 0.0 109.507 169.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -58.35 155.79 33.78 Favored 'Trans proline' 0 C--N 1.356 0.935 0 C-N-CA 124.239 3.293 . . . . 0.0 115.53 -173.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 102.04 -19.97 47.19 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 126.043 1.782 . . . . 0.0 112.036 -179.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -89.42 141.27 28.71 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.963 1.305 . . . . 0.0 111.282 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -143.05 176.86 8.77 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 114.474 1.287 . . . . 0.0 114.474 -172.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 50.7 p -83.99 -20.06 33.46 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 115.638 1.718 . . . . 0.0 115.638 -174.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 44.0 mtp-105 -69.26 -36.88 77.58 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 120.063 1.301 . . . . 0.0 111.995 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -92.46 130.4 38.14 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.978 1.311 . . . . 0.0 108.56 173.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -131.06 152.15 50.67 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.083 1.353 . . . . 0.0 111.374 -177.249 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 97.4 t -126.61 123.21 62.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 125.534 1.533 . . . . 0.0 108.88 175.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 95.8 m -122.77 126.95 48.47 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.326 1.05 . . . . 0.0 110.787 -177.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 3.2 tp-100 -76.18 134.72 39.83 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.645 1.578 . . . . 0.0 109.989 171.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 33.3 mt -90.29 164.39 27.62 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 124.054 0.942 . . . . 0.0 112.004 176.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -55.37 -21.28 28.93 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 123.872 3.048 . . . . 0.0 114.172 172.058 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -60.19 -26.16 66.14 Favored 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 176.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 89.84 -17.25 53.99 Favored Glycine 0 CA--C 1.535 1.32 0 C-N-CA 125.355 1.455 . . . . 0.0 114.602 173.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 5.3 ptt180 -152.44 73.54 1.03 Allowed 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 123.024 1.393 . . . . 0.0 109.178 169.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -169.92 137.54 1.65 Allowed 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 128.322 2.649 . . . . 0.0 107.304 -179.081 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -141.58 145.44 35.07 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 114.46 1.282 . . . . 0.0 114.46 -166.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 -102.53 121.22 41.94 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.044 1.338 . . . . 0.0 110.506 168.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -101.29 103.85 14.84 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 126.467 1.907 . . . . 0.0 107.948 176.369 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 14.8 m -114.52 121.88 44.84 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 114.136 1.162 . . . . 0.0 114.136 -167.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 12.8 t -88.59 118.04 33.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 C-N-CA 125.084 1.354 . . . . 0.0 107.509 168.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 98.0 t -78.86 117.31 24.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 124.25 1.02 . . . . 0.0 109.21 173.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 55.6 mtp180 48.37 76.92 0.11 Allowed 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 126.787 2.035 . . . . 0.0 111.876 178.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -69.77 138.17 52.53 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.422 1.089 . . . . 0.0 111.891 -176.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.78 161.16 17.88 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 126.235 1.814 . . . . 0.0 110.195 178.342 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 76.9 mtm180 -56.76 -23.07 40.28 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 114.387 1.255 . . . . 0.0 114.387 -178.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -65.16 -23.6 67.15 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 170.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -82.13 -16.84 48.52 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.226 1.01 . . . . 0.0 113.365 -178.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 49.8 m -59.59 134.67 57.23 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 119.743 1.156 . . . . 0.0 112.693 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 152.68 -169.12 31.75 Favored Glycine 0 N--CA 1.472 1.086 0 C-N-CA 124.812 1.196 . . . . 0.0 113.249 -174.119 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.0 m -93.12 147.49 22.82 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.314 1.046 . . . . 0.0 111.146 -178.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -141.52 159.49 42.1 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.804 2.041 . . . . 0.0 111.5 -177.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.0 pp -154.34 154.1 32.77 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.618 1.567 . . . . 0.0 111.152 172.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 29.5 p -102.13 157.7 16.7 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.305 0.642 . . . . 0.0 112.566 171.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -149.06 145.16 13.17 Favored Glycine 0 N--CA 1.472 1.075 0 C-N-CA 124.997 1.284 . . . . 0.0 113.89 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -125.38 159.26 32.25 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.971 1.309 . . . . 0.0 113.04 -173.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 16.9 tt -159.5 137.57 2.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 125.332 1.453 . . . . 0.0 111.176 178.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 17.8 m -70.92 161.45 31.03 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.143 0.977 . . . . 0.0 112.664 175.059 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 17.8 mt -77.04 -12.56 59.95 Favored 'General case' 0 N--CA 1.479 0.994 0 O-C-N 120.69 -1.256 . . . . 0.0 114.335 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -65.82 143.83 98.65 Favored Pre-proline 0 CA--C 1.552 1.041 0 C-N-CA 124.046 0.939 . . . . 0.0 112.377 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_exo -55.58 -27.67 61.21 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 123.782 2.988 . . . . 0.0 114.695 176.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -83.24 -1.61 53.56 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.719 1.208 . . . . 0.0 114.218 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -67.94 162.77 23.59 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.366 1.066 . . . . 0.0 113.474 -177.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.27 153.21 38.4 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.812 1.645 . . . . 0.0 108.814 178.004 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 64.9 mt -76.53 124.75 35.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 123.631 0.773 . . . . 0.0 111.828 -173.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -97.11 145.46 25.98 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.695 1.198 . . . . 0.0 108.116 165.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -130.16 148.96 52.05 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.461 1.028 . . . . 0.0 111.818 -179.059 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 4.9 t -94.51 -166.11 1.42 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.011 1.325 . . . . 0.0 113.126 -173.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 82.8 mt -64.68 155.3 33.93 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.615 1.566 . . . . 0.0 111.734 175.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 31.0 mtp-105 -89.38 139.22 30.73 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.548 1.139 . . . . 0.0 110.444 173.043 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -137.11 151.01 48.37 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.413 1.485 . . . . 0.0 111.419 178.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -103.85 137.76 41.4 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.428 1.091 . . . . 0.0 111.754 -177.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 63.1 tp -106.14 128.97 54.27 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 125.747 1.619 . . . . 0.0 108.905 169.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 71.4 ttt180 -120.52 118.24 29.71 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.516 1.527 . . . . 0.0 109.399 171.268 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 32.8 t -102.17 119.44 50.48 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 C-N-CA 124.494 1.118 . . . . 0.0 108.432 170.21 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 63.0 p -99.66 144.77 28.36 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.526 1.531 . . . . 0.0 110.078 179.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -62.82 145.07 55.86 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.795 -0.566 . . . . 0.0 112.459 -174.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 46.9 ttt85 -79.75 99.68 7.57 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.196 0.999 . . . . 0.0 110.857 -171.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -76.33 161.41 28.75 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.012 1.325 . . . . 0.0 113.077 -178.234 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -71.57 154.35 41.51 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.523 1.129 . . . . 0.0 112.489 175.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 . . . . . 0 C--O 1.253 1.242 0 C-N-CA 125.313 1.445 . . . . 0.0 112.6 176.475 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . 0.559 ' N ' ' HG ' ' A' ' 57' ' ' SER . 55.8 tpp . . . . . 0 N--CA 1.486 1.374 0 CA-C-O 118.916 -0.564 . . . . 0.0 110.61 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -71.42 162.74 41.38 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 122.752 2.301 . . . . 0.0 110.501 170.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -52.19 131.69 40.58 Favored 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 123.571 2.847 . . . . 0.0 113.558 177.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.0 t -159.3 141.85 13.94 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 126.269 1.828 . . . . 0.0 109.957 173.206 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.407 ' CD1' ' SG ' ' A' ' 123' ' ' CYS . 1.4 m-85 -127.39 141.95 51.55 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.143 0.977 . . . . 0.0 112.048 -168.202 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 95.9 p -141.08 159.39 61.89 Favored Pre-proline 0 CA--C 1.548 0.9 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 177.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -73.15 161.54 93.69 Favored 'Cis proline' 0 C--N 1.353 0.802 0 CA-C-N 118.925 0.652 . . . . 0.0 111.096 -11.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.5 -29.44 70.55 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 171.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 49.1 tp -140.53 121.93 15.01 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.82 1.648 . . . . 0.0 109.453 171.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 56.5 tp -104.81 126.68 52.13 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.74 1.616 . . . . 0.0 109.068 171.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 18.3 t -110.18 125.45 67.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 123.999 0.92 . . . . 0.0 108.533 171.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.1 m -129.47 165.14 30.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 124.671 1.188 . . . . 0.0 111.653 174.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 88.5 m -92.12 148.6 22.05 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.295 1.038 . . . . 0.0 109.849 171.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -56.23 123.8 15.78 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.987 0.915 . . . . 0.0 112.076 -177.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 93.58 -2.98 71.03 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 125.421 1.486 . . . . 0.0 114.74 -175.443 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -71.16 153.24 42.65 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.624 1.712 . . . . 0.0 111.461 169.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -84.28 106.53 15.97 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 169.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -94.25 123.18 37.49 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.863 0.865 . . . . 0.0 110.928 -172.047 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 42.0 m -131.63 126.83 35.69 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 119.051 0.841 . . . . 0.0 112.313 -170.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -98.29 156.74 16.57 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 126.139 1.776 . . . . 0.0 110.506 170.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.8 m -105.64 129.74 53.82 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.834 1.254 . . . . 0.0 109.18 171.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 67.8 m -115.84 124.4 50.59 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.58 1.152 . . . . 0.0 109.104 169.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 73.1 m -121.55 126.37 49.0 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 124.748 1.219 . . . . 0.0 110.075 -170.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 10.9 p90 -160.53 156.3 25.61 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.961 1.304 . . . . 0.0 110.583 177.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.559 ' HG ' ' N ' ' A' ' 33' ' ' MET . 63.1 m -83.26 114.65 21.53 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.26 -0.9 . . . . 0.0 110.074 177.291 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -67.58 146.61 53.72 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.813 1.245 . . . . 0.0 111.534 -175.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 62.2 p -77.12 152.57 34.88 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.083 0.953 . . . . 0.0 111.514 -178.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 24.6 m -77.47 -24.29 50.24 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 177.041 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -90.31 -32.7 16.4 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.406 1.083 . . . . 0.0 112.949 -174.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 8.6 t 128.96 165.17 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 131.416 3.886 . . . . 0.0 112.168 175.357 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 53.1 p90 -157.12 169.0 25.78 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.022 1.729 . . . . 0.0 112.283 -168.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 17.6 t -125.42 133.68 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 125.744 1.617 . . . . 0.0 107.786 168.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -105.89 136.17 46.02 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.138 1.375 . . . . 0.0 108.913 173.552 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -126.82 150.96 48.92 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.119 1.367 . . . . 0.0 111.502 178.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 14.0 t90 -127.59 138.93 53.01 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.242 1.417 . . . . 0.0 111.847 178.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -134.74 151.31 50.88 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.612 1.565 . . . . 0.0 113.815 -171.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -112.08 141.19 46.07 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.556 1.542 . . . . 0.0 109.328 168.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 84.5 mmm -73.79 137.73 44.06 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.473 0.709 . . . . 0.0 111.642 174.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 67.7 m -94.26 156.6 38.68 Favored Pre-proline 0 CA--C 1.548 0.882 0 C-N-CA 124.723 1.209 . . . . 0.0 111.57 170.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -55.65 -32.74 84.76 Favored 'Trans proline' 0 C--N 1.354 0.857 0 C-N-CA 124.038 3.159 . . . . 0.0 114.648 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.3 m -76.99 5.73 7.52 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.804 1.241 . . . . 0.0 113.835 178.113 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 72.93 21.01 3.38 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 127.843 2.457 . . . . 0.0 112.98 -175.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -90.41 -175.08 4.36 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.589 1.156 . . . . 0.0 110.314 170.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.9 p -139.02 145.26 39.42 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 125.618 1.567 . . . . 0.0 110.024 -175.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -121.27 131.48 54.24 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.165 0.986 . . . . 0.0 111.193 176.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -80.97 123.07 28.03 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.237 1.415 . . . . 0.0 110.773 -175.012 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 45.5 mt -100.94 -53.54 3.02 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.864 1.266 . . . . 0.0 112.2 -168.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -161.16 167.28 26.46 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.273 1.829 . . . . 0.0 110.014 -169.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.63 166.85 29.8 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.974 0.91 . . . . 0.0 112.292 -172.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 74.1 t80 -144.99 114.57 4.99 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 124.511 1.124 . . . . 0.0 110.558 170.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -55.71 154.05 23.41 Favored 'Cis proline' 0 C--N 1.351 0.671 0 CA-C-N 119.772 0.954 . . . . 0.0 112.567 -11.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -68.17 110.76 4.15 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.74 0.781 . . . . 0.0 112.134 -177.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -83.83 -8.16 59.28 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.797 1.639 . . . . 0.0 113.468 176.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 39.3 ptt180 -90.85 10.38 26.46 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 126.789 2.035 . . . . 0.0 114.668 -174.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 44.7 m -74.6 58.15 0.77 Allowed 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 125.841 1.656 . . . . 0.0 113.771 -173.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 61.5 mm-40 -129.95 160.88 62.97 Favored Pre-proline 0 CA--C 1.547 0.859 0 C-N-CA 127.3 2.24 . . . . 0.0 109.492 176.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -52.26 138.63 55.03 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 123.701 2.934 . . . . 0.0 113.554 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 85.93 42.79 6.61 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 123.902 0.763 . . . . 0.0 112.96 -174.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -67.44 149.83 49.72 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.464 1.106 . . . . 0.0 112.387 -177.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -82.12 150.76 27.3 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.001 1.32 . . . . 0.0 112.741 173.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 9.1 t -110.03 -25.1 10.42 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.01 1.324 . . . . 0.0 114.132 176.502 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -76.84 -46.71 23.75 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 121.009 -1.057 . . . . 0.0 113.63 -170.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -95.8 140.94 29.86 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.427 1.091 . . . . 0.0 112.161 -168.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 58.9 ttt180 -144.54 147.27 33.01 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.11 1.364 . . . . 0.0 112.081 176.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 84.7 t -115.72 126.74 73.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 126.176 1.791 . . . . 0.0 108.763 170.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 98.5 m -130.51 132.29 45.55 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.361 1.464 . . . . 0.0 110.39 -177.276 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -77.68 138.47 39.09 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.09 0.556 . . . . 0.0 110.231 172.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 20.2 mt -76.85 156.44 82.55 Favored Pre-proline 0 CA--C 1.544 0.743 0 O-C-N 121.704 -0.622 . . . . 0.0 111.788 171.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -66.46 -6.4 15.03 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.504 2.802 . . . . 0.0 113.44 172.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -60.04 -26.09 65.85 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 124.086 0.955 . . . . 0.0 112.98 169.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 88.28 -10.58 70.69 Favored Glycine 0 CA--C 1.534 1.246 0 C-N-CA 125.079 1.323 . . . . 0.0 115.041 178.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 32.6 ptt180 -154.58 73.61 0.91 Allowed 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 118.76 1.28 . . . . 0.0 111.533 173.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -178.76 148.37 0.42 Allowed 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 128.157 2.583 . . . . 0.0 108.912 -177.388 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -138.01 146.6 43.27 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.793 0.837 . . . . 0.0 112.925 -177.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 6.6 m170 -109.2 131.26 55.24 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.033 1.733 . . . . 0.0 111.537 169.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -114.06 105.1 12.81 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 126.706 2.002 . . . . 0.0 107.762 -176.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 38.2 p -115.1 133.14 56.3 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 -168.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 15.4 t -96.25 104.71 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 126.772 2.029 . . . . 0.0 106.91 168.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 95.8 t -74.52 114.8 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 124.537 1.135 . . . . 0.0 108.742 177.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 10.1 mpt_? 55.34 84.96 0.07 Allowed 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 126.257 1.823 . . . . 0.0 111.317 -173.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -73.76 118.23 16.46 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.744 0.817 . . . . 0.0 111.213 178.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 9.4 mpt_? -85.82 159.86 19.61 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.41 1.484 . . . . 0.0 109.383 171.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 17.1 mmm180 -49.2 -39.17 28.53 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 120.937 -1.102 . . . . 0.0 113.011 172.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -67.36 -10.07 47.55 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 178.011 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -84.6 -8.45 58.89 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 120.107 1.321 . . . . 0.0 112.871 172.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.4 m -64.35 136.69 57.38 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 120.155 -1.59 . . . . 0.0 112.438 177.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 155.24 -166.74 32.72 Favored Glycine 0 N--CA 1.468 0.786 0 C-N-CA 124.101 0.858 . . . . 0.0 113.016 -178.462 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.0 m -97.26 140.42 31.77 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.525 1.13 . . . . 0.0 110.803 -176.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -135.73 163.0 31.17 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.3 1.84 . . . . 0.0 112.175 -177.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -162.13 146.62 12.46 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.568 1.547 . . . . 0.0 112.589 171.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . 0.407 ' SG ' ' CD1' ' A' ' 37' ' ' PHE . 1.8 p -108.54 170.69 7.86 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.038 1.735 . . . . 0.0 111.026 176.247 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -175.35 142.37 6.16 Favored Glycine 0 N--CA 1.471 1.026 0 O-C-N 121.237 -0.915 . . . . 0.0 114.184 177.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -109.73 148.2 31.84 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.567 1.147 . . . . 0.0 112.765 -176.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 21.3 tt -138.01 143.7 32.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 126.667 1.987 . . . . 0.0 110.078 177.125 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.7 m -67.5 161.56 25.2 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.871 0.868 . . . . 0.0 112.835 176.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -59.02 -25.74 63.94 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 115.223 1.564 . . . . 0.0 115.223 178.038 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -81.73 148.13 60.76 Favored Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 124.876 1.27 . . . . 0.0 112.52 -174.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -69.91 -24.97 28.4 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 123.261 2.64 . . . . 0.0 114.107 -171.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.3 -0.97 30.89 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.84 1.422 . . . . 0.0 114.84 178.517 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.79 173.95 5.71 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.512 1.525 . . . . 0.0 113.196 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 53.8 tp60 -134.99 143.84 47.05 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.114 1.766 . . . . 0.0 109.171 179.041 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 53.7 mt -72.45 114.84 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 170.419 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -85.13 112.74 20.96 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.396 1.079 . . . . 0.0 111.027 -178.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -90.67 158.88 16.68 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.033 1.733 . . . . 0.0 112.048 -177.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 4.9 t -145.98 -166.85 2.57 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.994 0.918 . . . . 0.0 111.799 169.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.88 136.55 57.03 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.727 1.211 . . . . 0.0 113.094 -172.685 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 80.0 mtt85 -72.43 146.33 47.03 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.709 0.804 . . . . 0.0 111.529 -177.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -120.78 135.58 55.12 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.064 1.745 . . . . 0.0 110.688 -176.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -104.42 139.28 39.59 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.341 1.056 . . . . 0.0 111.728 -175.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 52.5 tp -109.62 127.91 54.86 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.8 1.64 . . . . 0.0 109.659 171.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 60.7 ttt85 -118.25 119.29 34.21 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.678 1.591 . . . . 0.0 109.179 170.127 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 43.6 t -102.0 123.15 55.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 171.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 68.6 p -99.0 145.47 27.04 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.566 1.546 . . . . 0.0 109.208 175.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -66.43 141.81 57.8 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 121.54 -0.725 . . . . 0.0 111.754 -175.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -87.05 126.37 34.71 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.186 0.994 . . . . 0.0 110.598 -179.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 75.3 ttt180 -72.48 142.15 48.57 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.039 0.936 . . . . 0.0 111.438 -178.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -70.14 154.34 42.04 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.502 1.121 . . . . 0.0 112.828 177.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 . . . . . 0 C--O 1.254 1.322 0 C-N-CA 124.964 1.306 . . . . 0.0 114.496 176.837 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 19.0 mmt . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 118.363 -0.827 . . . . 0.0 110.79 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo -56.7 -47.77 21.97 Favored 'Trans proline' 0 CA--C 1.545 1.067 0 C-N-CA 123.602 2.868 . . . . 0.0 114.21 170.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -76.46 157.36 36.66 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 122.4 2.067 . . . . 0.0 112.105 170.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 15.3 t -164.66 152.76 12.13 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 125.203 1.401 . . . . 0.0 111.639 174.155 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.408 ' CE1' ' HB2' ' A' ' 123' ' ' CYS . 1.9 m-85 -125.0 136.61 53.89 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.405 1.482 . . . . 0.0 110.714 -169.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 88.7 p -140.96 157.24 67.72 Favored Pre-proline 0 CA--C 1.548 0.894 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 177.639 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -70.37 160.59 89.59 Favored 'Cis proline' 0 C--N 1.352 0.716 0 CA-C-N 119.0 0.679 . . . . 0.0 110.887 -11.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.46 -30.71 69.84 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 172.284 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 49.8 tp -140.32 120.68 14.0 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.569 1.548 . . . . 0.0 109.358 171.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 61.0 tp -102.83 127.02 50.17 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.45 1.5 . . . . 0.0 109.171 172.129 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.6 t -109.7 124.9 66.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 123.902 0.881 . . . . 0.0 108.811 171.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.2 m -127.17 169.91 17.88 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 124.639 1.176 . . . . 0.0 111.551 172.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 94.5 m -100.66 147.28 26.16 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.043 1.337 . . . . 0.0 110.058 173.101 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -59.27 126.6 28.33 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.178 0.991 . . . . 0.0 111.823 -174.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 91.65 -2.84 77.7 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 125.993 1.759 . . . . 0.0 114.473 -174.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 38.3 t0 -83.35 156.84 22.8 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.841 1.821 . . . . 0.0 112.004 173.267 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -79.21 123.75 27.7 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.567 0.747 . . . . 0.0 109.806 170.175 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -102.66 129.4 49.24 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 117.68 -1.152 . . . . 0.0 110.567 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 31.3 m -132.79 129.65 38.84 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 119.377 0.99 . . . . 0.0 112.222 -177.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -106.21 159.62 15.96 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 127.625 2.37 . . . . 0.0 110.731 169.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 85.9 m -109.76 134.72 51.7 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.5 1.52 . . . . 0.0 109.108 170.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 64.2 m -131.55 125.74 33.09 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.981 1.312 . . . . 0.0 110.237 172.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 91.2 p -104.29 148.17 26.67 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.099 0.96 . . . . 0.0 110.817 175.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -145.23 151.19 38.0 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 124.852 1.261 . . . . 0.0 112.347 178.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.0 t -153.79 143.1 21.49 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.727 0.811 . . . . 0.0 110.799 168.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 62.9 m-80 -135.92 162.85 31.68 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.878 1.671 . . . . 0.0 110.648 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 21.3 p -68.25 -26.26 65.6 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.108 1.363 . . . . 0.0 112.901 178.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 23.5 p -81.54 161.29 23.64 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.205 1.802 . . . . 0.0 112.194 169.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -70.45 -24.6 62.92 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.636 1.574 . . . . 0.0 113.044 -175.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.6 t -156.96 164.13 38.36 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.156 1.382 . . . . 0.0 111.684 -174.189 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 35.0 p90 -162.88 166.15 24.34 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.973 1.709 . . . . 0.0 111.318 -169.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 50.6 t -95.87 124.34 48.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 N-CA-C 107.559 -1.274 . . . . 0.0 107.559 170.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.58 HD11 ' HE1' ' A' ' 108' ' ' MET . 2.2 tm? -99.33 141.76 31.68 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 126.655 1.982 . . . . 0.0 108.896 177.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -141.96 154.91 45.39 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.932 1.693 . . . . 0.0 111.258 -175.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 20.3 t90 -128.2 143.0 51.0 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.944 1.298 . . . . 0.0 111.395 175.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -138.13 148.3 44.79 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.818 1.247 . . . . 0.0 114.164 -170.356 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 53.5 ttt-85 -109.19 143.19 38.93 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.234 1.414 . . . . 0.0 109.65 168.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 85.7 mmm -75.38 135.07 40.82 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 118.333 0.515 . . . . 0.0 111.368 173.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.2 p -85.7 165.64 34.06 Favored Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 123.478 0.711 . . . . 0.0 112.429 172.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -58.62 -28.31 85.65 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 123.45 2.767 . . . . 0.0 113.498 170.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.7 m -83.52 0.96 44.24 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.874 1.27 . . . . 0.0 113.277 175.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 74.05 21.71 2.51 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 127.613 2.365 . . . . 0.0 113.429 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 18.7 mm100 -87.42 -178.96 6.28 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.71 0.804 . . . . 0.0 110.393 169.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.8 p -126.83 119.35 26.62 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.94 1.696 . . . . 0.0 109.388 -173.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -104.07 128.62 51.7 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.717 0.807 . . . . 0.0 111.199 -179.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -76.53 127.62 33.18 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.045 0.938 . . . . 0.0 112.065 -172.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 66.2 mt -106.75 -44.35 4.47 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 125.343 1.457 . . . . 0.0 112.406 -169.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -166.97 169.71 12.75 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.479 1.912 . . . . 0.0 110.432 -176.1 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.56 165.77 32.18 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.645 1.178 . . . . 0.0 112.76 -171.134 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 75.0 t80 -147.49 123.0 5.29 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 125.388 1.475 . . . . 0.0 110.533 170.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -55.65 144.73 19.24 Favored 'Cis proline' 0 C--N 1.351 0.665 0 CA-C-N 120.126 1.081 . . . . 0.0 111.94 -10.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -82.72 150.07 26.93 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-O 121.539 0.685 . . . . 0.0 112.567 -176.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -152.78 38.93 0.53 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.52 1.528 . . . . 0.0 110.731 -177.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.3 mmm180 -63.89 -6.97 6.83 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 115.97 1.841 . . . . 0.0 115.97 -168.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 36.4 p -68.77 -9.49 51.12 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.491 1.117 . . . . 0.0 113.713 169.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -61.26 163.65 10.35 Favored Pre-proline 0 CA--C 1.551 0.982 0 C-N-CA 124.393 1.077 . . . . 0.0 112.701 169.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.8 135.8 71.32 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 122.918 2.412 . . . . 0.0 110.638 168.116 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 89.26 36.03 7.77 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 123.502 0.572 . . . . 0.0 112.454 -169.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -69.88 126.12 28.75 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.184 1.394 . . . . 0.0 110.853 176.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -143.02 145.98 33.42 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.004 1.321 . . . . 0.0 111.744 174.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 51.9 m -109.7 -7.4 15.08 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 -179.273 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 48.5 mtp180 -84.61 -32.95 23.45 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.672 1.189 . . . . 0.0 112.567 179.709 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -88.63 142.38 27.74 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.368 1.067 . . . . 0.0 111.388 176.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 48.6 mtm180 -143.0 154.16 43.71 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.054 1.341 . . . . 0.0 112.79 -172.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 37.6 t -126.49 134.05 67.25 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 126.392 1.877 . . . . 0.0 108.702 168.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 95.3 m -123.91 126.06 45.71 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.262 1.425 . . . . 0.0 108.666 169.325 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 6.8 pm0 -83.62 141.56 31.45 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.322 1.049 . . . . 0.0 111.146 174.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 18.1 mt -87.81 156.25 52.72 Favored Pre-proline 0 CA--C 1.542 0.668 0 C-N-CA 123.685 0.794 . . . . 0.0 111.526 178.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -66.43 -4.61 11.05 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 123.361 2.708 . . . . 0.0 114.148 176.163 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -71.83 -10.5 59.87 Favored 'General case' 0 CA--C 1.551 1.015 0 CA-C-N 119.895 1.225 . . . . 0.0 113.281 171.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 92.15 -19.43 49.58 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 125.775 1.655 . . . . 0.0 116.024 169.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 11.9 ptp180 -154.63 73.65 0.91 Allowed 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 122.736 1.255 . . . . 0.0 110.842 173.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -167.43 144.77 4.53 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 128.7 2.8 . . . . 0.0 107.834 -176.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -146.66 147.52 31.11 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 113.82 1.044 . . . . 0.0 113.82 -168.3 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 51.6 m170 -109.0 127.93 54.51 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.827 1.651 . . . . 0.0 109.758 168.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.58 ' HE1' HD11 ' A' ' 65' ' ' LEU . 1.1 mpt? -113.52 126.74 55.65 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 126.253 1.821 . . . . 0.0 108.592 -176.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 93.7 p -142.67 149.06 38.38 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 116.841 2.163 . . . . 0.0 116.841 -171.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 11.1 t -103.41 122.44 55.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 126.849 2.059 . . . . 0.0 108.684 174.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 86.3 t -73.59 120.98 23.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 124.382 1.073 . . . . 0.0 109.675 169.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 49.3 72.61 0.29 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 126.006 1.722 . . . . 0.0 111.807 172.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.58 135.4 52.85 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.367 1.067 . . . . 0.0 111.954 -172.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -102.88 157.8 16.72 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 126.312 1.845 . . . . 0.0 109.937 175.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 74.9 mtm180 -52.47 -30.39 29.59 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 175.388 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 32.1 t30 -63.14 -24.74 68.03 Favored 'General case' 0 CA--C 1.551 1.009 0 N-CA-C 114.927 1.455 . . . . 0.0 114.927 173.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -74.82 -21.19 59.42 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 119.811 1.187 . . . . 0.0 112.87 -179.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 17.6 m -57.65 131.86 51.53 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.552 1.141 . . . . 0.0 113.198 -175.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 156.64 -165.92 33.17 Favored Glycine 0 CA--C 1.529 0.961 0 C-N-CA 124.523 1.059 . . . . 0.0 113.157 -172.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.4 m -93.25 143.01 26.68 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.058 1.343 . . . . 0.0 111.139 -175.284 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 61.9 m-85 -140.81 157.3 45.59 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.702 1.601 . . . . 0.0 111.515 -177.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.6 pp -154.98 156.24 35.65 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.285 1.034 . . . . 0.0 111.857 173.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . 0.408 ' HB2' ' CE1' ' A' ' 37' ' ' PHE . 79.6 m -101.77 162.38 12.95 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.002 0.921 . . . . 0.0 110.741 173.539 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -155.11 158.83 28.65 Favored Glycine 0 N--CA 1.47 0.929 0 O-C-N 121.473 -0.767 . . . . 0.0 112.98 173.314 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -146.98 156.7 43.26 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 117.952 0.876 . . . . 0.0 112.766 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.0 tt -146.98 134.39 14.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 124.829 1.252 . . . . 0.0 110.983 -175.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 48.2 t -61.84 158.18 16.52 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.045 0.938 . . . . 0.0 113.068 178.666 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 68.4 mt -72.95 -12.61 61.01 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.26 1.024 . . . . 0.0 112.949 176.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -67.43 143.95 97.56 Favored Pre-proline 0 CA--C 1.554 1.1 0 C-N-CA 124.451 1.1 . . . . 0.0 112.583 177.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_exo -57.33 -30.77 88.94 Favored 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 123.624 2.883 . . . . 0.0 114.846 177.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -87.93 7.23 31.89 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 124.687 1.195 . . . . 0.0 114.163 -176.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.78 165.99 14.06 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.928 1.291 . . . . 0.0 114.319 -175.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 31.2 tt0 -146.49 149.88 34.5 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.215 1.806 . . . . 0.0 109.116 178.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 56.1 mt -73.39 124.64 30.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 123.377 0.671 . . . . 0.0 111.112 -176.002 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -84.81 142.99 29.38 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.037 1.735 . . . . 0.0 110.904 172.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -142.79 158.89 43.18 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.978 1.711 . . . . 0.0 110.638 -175.325 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 5.5 t -144.12 -171.57 3.59 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.424 1.09 . . . . 0.0 111.947 175.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -63.25 125.23 23.42 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.182 1.393 . . . . 0.0 110.585 -176.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -65.56 163.77 15.48 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 -173.15 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.96 168.21 10.27 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.021 2.129 . . . . 0.0 111.317 175.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -131.52 142.95 50.06 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.883 1.273 . . . . 0.0 111.623 177.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 66.1 tp -109.87 133.81 52.75 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 125.954 1.701 . . . . 0.0 109.883 170.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 72.0 ttt180 -123.94 120.14 31.64 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.676 1.59 . . . . 0.0 108.986 169.055 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 44.4 t -104.19 120.34 54.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 170.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 67.2 p -98.22 148.75 23.28 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.234 1.814 . . . . 0.0 109.521 177.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -64.02 151.01 44.07 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.313 -0.867 . . . . 0.0 113.226 -172.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 48.3 ttt85 -73.36 125.0 26.84 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 123.953 0.901 . . . . 0.0 108.638 -173.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 33.7 ptt-85 -143.22 159.78 41.68 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.966 0.906 . . . . 0.0 113.153 -167.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -73.36 154.28 40.14 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.846 1.258 . . . . 0.0 112.589 175.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 . . . . . 0 C--O 1.255 1.365 0 C-N-CA 125.24 1.416 . . . . 0.0 113.359 175.83 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . 0.51 ' N ' ' HG ' ' A' ' 57' ' ' SER . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.408 0 CA-C-O 118.806 -0.616 . . . . 0.0 110.453 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.12 147.68 67.5 Favored 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 122.768 2.312 . . . . 0.0 109.878 172.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -68.11 119.16 6.17 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 123.8 3.0 . . . . 0.0 111.462 -169.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 6.0 t -166.63 171.12 11.96 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.296 1.438 . . . . 0.0 111.44 -174.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.46 ' CD2' ' HB2' ' A' ' 123' ' ' CYS . 0.9 OUTLIER -160.28 157.86 28.82 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 125.943 1.697 . . . . 0.0 113.243 176.708 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 95.1 p -140.78 158.74 64.72 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 125.163 1.385 . . . . 0.0 112.568 174.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -73.48 160.88 95.18 Favored 'Cis proline' 0 C--N 1.351 0.686 0 CA-C-N 118.485 0.495 . . . . 0.0 111.311 -9.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.75 -30.58 71.59 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 171.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 45.9 tp -136.79 117.67 14.17 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.947 1.699 . . . . 0.0 109.046 171.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.2 tp -100.69 127.36 47.12 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.43 1.492 . . . . 0.0 109.439 174.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.0 t -109.99 124.2 66.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 123.979 0.911 . . . . 0.0 108.809 172.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.4 m -127.86 167.06 23.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 124.916 1.286 . . . . 0.0 111.595 172.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 67.1 m -93.4 148.49 22.02 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.485 1.114 . . . . 0.0 110.145 174.624 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -53.93 119.9 5.64 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.885 1.274 . . . . 0.0 111.708 177.359 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 94.59 -3.28 68.22 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 126.104 1.812 . . . . 0.0 114.886 -177.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -88.83 155.18 19.7 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 119.281 1.54 . . . . 0.0 111.582 174.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -80.82 134.61 35.81 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.292 -0.88 . . . . 0.0 111.437 173.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -107.22 131.75 53.83 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.13 1.772 . . . . 0.0 110.592 178.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 28.6 m -132.75 125.09 29.37 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.846 0.858 . . . . 0.0 111.302 -179.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -101.49 153.23 19.89 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.249 1.42 . . . . 0.0 110.357 169.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 66.9 m -117.05 117.67 30.27 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.213 1.005 . . . . 0.0 110.166 178.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 21.6 m -101.0 151.12 22.16 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.699 1.2 . . . . 0.0 113.157 169.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 70.3 m -127.05 115.42 19.17 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.01 1.324 . . . . 0.0 109.207 174.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -144.13 152.73 41.33 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 126.291 1.837 . . . . 0.0 110.083 -178.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.51 ' HG ' ' N ' ' A' ' 33' ' ' MET . 78.6 p -153.52 148.15 26.25 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.368 1.067 . . . . 0.0 111.463 169.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 55.3 m-80 -136.86 -174.05 3.61 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.417 1.487 . . . . 0.0 110.982 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 70.8 p -68.49 168.69 12.29 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.673 1.589 . . . . 0.0 112.794 -176.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.5 m -60.8 -9.4 4.01 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.712 1.605 . . . . 0.0 114.649 -179.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 38.4 mm-40 -67.22 -20.37 65.68 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 124.709 1.204 . . . . 0.0 112.643 170.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.6 t 84.76 166.84 0.09 Allowed 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 127.982 2.513 . . . . 0.0 113.126 176.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 24.4 p90 -154.27 159.31 41.22 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 -170.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 45.7 t -110.85 134.0 54.53 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 C-N-CA 127.076 2.15 . . . . 0.0 107.847 171.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 30.8 tp -109.17 134.14 52.11 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.324 0.65 . . . . 0.0 110.087 169.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -124.96 148.98 48.13 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.505 1.522 . . . . 0.0 111.241 -169.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 34.6 t-105 -110.22 138.83 46.07 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.4 1.48 . . . . 0.0 111.665 175.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -132.99 146.03 51.4 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.1 1.36 . . . . 0.0 112.441 -177.07 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 38.5 ttp180 -91.7 136.59 33.02 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.693 1.597 . . . . 0.0 107.541 167.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 16.6 ttm -111.44 133.14 53.95 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.972 1.309 . . . . 0.0 110.206 -179.168 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 51.0 m -85.62 160.61 53.07 Favored Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 125.301 1.44 . . . . 0.0 112.391 179.046 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_exo -58.56 -26.39 78.46 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 124.237 3.291 . . . . 0.0 114.136 174.36 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.9 p -76.95 1.32 18.06 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.891 1.677 . . . . 0.0 113.643 174.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 30.5 m-80 69.81 20.98 6.59 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 127.635 2.374 . . . . 0.0 112.786 -176.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -85.84 169.85 12.94 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.637 0.775 . . . . 0.0 110.364 169.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.7 p -138.92 152.48 47.77 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.967 1.307 . . . . 0.0 111.974 -173.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -136.9 131.11 32.66 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.362 1.865 . . . . 0.0 110.296 -178.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -85.05 129.27 34.83 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.16 0.984 . . . . 0.0 111.96 -173.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 55.5 mt -107.44 -57.1 2.13 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.282 1.033 . . . . 0.0 110.892 -172.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -162.18 173.84 13.73 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.526 1.13 . . . . 0.0 111.286 -173.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.62 172.17 18.28 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.104 1.361 . . . . 0.0 111.639 -177.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 45.6 t80 -138.46 118.36 9.79 Favored Pre-proline 0 CA--C 1.546 0.791 0 CA-C-O 118.507 -0.759 . . . . 0.0 110.521 168.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -59.14 144.98 32.5 Favored 'Cis proline' 0 C--N 1.353 0.768 0 CA-C-N 119.375 0.813 . . . . 0.0 111.153 -8.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -74.06 138.14 43.82 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -168.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -97.69 18.98 14.37 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.989 1.715 . . . . 0.0 112.526 -174.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 28.8 mmm180 -64.4 -48.42 75.46 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.587 1.155 . . . . 0.0 112.161 -176.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 42.8 m 59.78 19.01 7.83 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 125.75 1.62 . . . . 0.0 115.351 169.445 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -135.87 149.96 70.19 Favored Pre-proline 0 CA--C 1.543 0.71 0 C-N-CA 125.345 1.458 . . . . 0.0 112.052 -169.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -54.58 132.03 49.03 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 123.528 2.819 . . . . 0.0 111.48 170.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 82.6 -9.13 59.88 Favored Glycine 0 CA--C 1.534 1.258 0 CA-C-O 118.403 -1.22 . . . . 0.0 114.413 -176.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 56.84 -101.11 0.12 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 127.135 2.174 . . . . 0.0 112.171 171.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -142.98 145.13 32.68 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.383 1.873 . . . . 0.0 109.812 167.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.9 p -86.0 -17.22 35.89 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 115.26 1.578 . . . . 0.0 115.26 -177.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.3 ptm180 -153.63 -18.01 0.14 Allowed 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 116.72 2.119 . . . . 0.0 116.72 -169.523 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -103.63 117.23 33.93 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.831 1.252 . . . . 0.0 109.751 176.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 15.8 mmt180 -144.43 155.51 43.78 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.697 0.799 . . . . 0.0 112.277 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 31.1 t -126.56 140.39 49.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 C-N-CA 125.085 1.354 . . . . 0.0 110.582 176.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 96.3 m -130.63 134.28 46.84 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 125.474 1.509 . . . . 0.0 111.098 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -78.79 135.33 37.06 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.997 1.319 . . . . 0.0 109.967 169.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 21.5 mt -82.11 159.29 65.63 Favored Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 124.187 0.995 . . . . 0.0 112.386 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -64.2 -6.89 12.39 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 123.301 2.667 . . . . 0.0 114.287 174.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -73.85 -7.65 53.03 Favored 'General case' 0 CA--C 1.551 1.017 0 CA-C-N 120.022 1.283 . . . . 0.0 113.261 170.009 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 83.49 -14.07 43.03 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 125.518 1.532 . . . . 0.0 116.092 169.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.57 73.52 0.91 Allowed 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 123.103 1.43 . . . . 0.0 111.341 172.085 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -171.47 145.41 2.08 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 128.482 2.713 . . . . 0.0 108.186 -176.356 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -142.96 141.68 31.48 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -168.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 23.0 m170 -102.57 130.34 49.4 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.598 1.559 . . . . 0.0 110.806 169.024 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -114.77 111.54 21.4 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.974 1.71 . . . . 0.0 108.621 179.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 32.4 m -110.37 130.46 55.55 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.623 1.169 . . . . 0.0 112.935 -168.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 34.0 t -110.47 101.41 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 126.889 2.076 . . . . 0.0 107.112 168.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 70.9 t -74.32 133.87 30.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 123.785 0.834 . . . . 0.0 110.266 -178.361 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 39.1 ttm180 57.2 62.84 2.06 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.911 1.284 . . . . 0.0 110.737 172.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.41 135.38 47.22 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 124.475 1.11 . . . . 0.0 111.173 -175.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.98 167.31 10.49 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.29 1.436 . . . . 0.0 111.026 175.336 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 12.2 mtp180 -58.86 -23.02 60.26 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 113.915 1.079 . . . . 0.0 113.915 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -69.34 -21.98 63.79 Favored 'General case' 0 CA--C 1.553 1.07 0 N-CA-C 114.104 1.15 . . . . 0.0 114.104 170.501 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -77.23 -20.12 55.68 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 119.771 1.169 . . . . 0.0 113.565 174.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 49.1 m -57.29 129.22 40.8 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 119.86 1.209 . . . . 0.0 112.358 -178.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 154.55 -166.71 32.35 Favored Glycine 0 N--CA 1.471 0.991 0 C-N-CA 124.218 0.913 . . . . 0.0 113.421 -171.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.3 m -91.01 143.64 26.5 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.436 1.094 . . . . 0.0 110.998 -175.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -140.73 158.06 44.52 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.637 1.975 . . . . 0.0 110.619 176.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.4 pp -158.03 166.48 32.43 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 120.839 -1.163 . . . . 0.0 113.466 -178.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . 0.46 ' HB2' ' CD2' ' A' ' 37' ' ' PHE . 0.1 OUTLIER -114.19 135.89 53.55 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.226 1.81 . . . . 0.0 110.697 -174.585 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -138.99 130.37 4.83 Favored Glycine 0 N--CA 1.472 1.072 0 C-N-CA 123.997 0.808 . . . . 0.0 113.276 179.186 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -102.72 155.07 18.56 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.75 1.22 . . . . 0.0 112.725 -176.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 19.2 tt -155.93 144.52 12.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 125.339 1.455 . . . . 0.0 109.57 176.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 2.2 m -65.27 161.58 19.15 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 121.045 -1.035 . . . . 0.0 112.971 178.505 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 59.2 tp -60.58 -34.66 74.52 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.112 0.965 . . . . 0.0 112.154 169.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -66.83 127.88 93.64 Favored Pre-proline 0 CA--C 1.554 1.133 0 C-N-CA 124.481 1.112 . . . . 0.0 111.891 178.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -56.69 -24.59 55.59 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 124.108 3.205 . . . . 0.0 115.834 -178.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -70.6 -6.45 36.75 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 178.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.06 173.23 5.69 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.458 1.503 . . . . 0.0 114.103 -178.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -140.5 161.77 36.93 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.215 1.806 . . . . 0.0 109.668 174.481 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 28.4 mt -82.7 124.36 39.31 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 CA-C-O 121.174 0.511 . . . . 0.0 111.44 -169.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -91.41 127.31 36.8 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.342 1.857 . . . . 0.0 110.178 171.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -137.25 139.1 40.76 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.101 1.36 . . . . 0.0 111.041 -178.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 57.5 m -147.74 143.51 27.62 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.812 1.645 . . . . 0.0 110.063 171.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 42.6 mt 66.84 -178.55 0.21 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 126.978 2.111 . . . . 0.0 113.526 176.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.4 145.73 20.63 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.243 1.817 . . . . 0.0 110.572 169.656 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.86 165.09 13.48 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.829 1.652 . . . . 0.0 110.897 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -127.35 136.09 51.41 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 124.392 1.077 . . . . 0.0 110.23 -171.3 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 62.5 tp -110.36 131.89 54.66 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 125.554 1.541 . . . . 0.0 109.598 174.117 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 70.8 ttt180 -122.86 120.97 35.06 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.717 1.607 . . . . 0.0 109.566 170.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 28.7 t -104.41 118.22 51.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 C-N-CA 124.429 1.092 . . . . 0.0 109.026 170.155 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 71.9 p -98.5 155.71 17.13 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.738 1.615 . . . . 0.0 110.935 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -64.45 141.24 58.84 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 121.61 0.719 . . . . 0.0 112.347 -177.219 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 26.0 ttp-105 -80.62 123.48 28.18 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.133 1.373 . . . . 0.0 110.166 179.279 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 34.3 ttp180 -74.39 149.07 40.67 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.764 0.826 . . . . 0.0 111.749 -177.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -66.55 154.24 40.9 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 123.664 0.786 . . . . 0.0 110.572 167.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 . . . . . 0 C--O 1.252 1.221 0 C-N-CA 125.703 1.601 . . . . 0.0 114.196 -174.988 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 21.8 mmt . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 116.481 -1.724 . . . . 0.0 112.754 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -64.83 159.91 43.45 Favored 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 122.393 2.062 . . . . 0.0 111.533 174.172 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -75.6 101.95 1.54 Allowed 'Trans proline' 0 C--N 1.351 0.671 0 C-N-CA 124.069 3.179 . . . . 0.0 110.875 -174.425 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 91.8 m -124.32 148.22 47.61 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 125.015 1.326 . . . . 0.0 110.463 -171.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 50.6 t80 -145.47 118.88 9.0 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.225 1.81 . . . . 0.0 109.27 175.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 71.7 m -140.77 159.97 60.48 Favored Pre-proline 0 N--CA 1.477 0.886 0 C-N-CA 124.306 1.042 . . . . 0.0 113.352 -168.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -70.03 156.69 93.39 Favored 'Cis proline' 0 C--N 1.354 0.832 0 CA-C-N 119.723 0.937 . . . . 0.0 111.415 -4.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.03 -21.92 64.06 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 176.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 51.5 tp -143.68 121.68 12.09 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.311 1.444 . . . . 0.0 108.876 169.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 49.7 tp -111.12 126.96 55.39 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.536 1.534 . . . . 0.0 109.264 173.233 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 40.3 t -115.78 120.08 63.74 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 124.219 1.008 . . . . 0.0 108.927 176.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 26.9 m -123.64 166.97 18.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 125.57 1.548 . . . . 0.0 111.72 174.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 24.4 m -90.95 151.11 21.21 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.796 1.238 . . . . 0.0 110.701 174.227 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -51.73 124.87 13.42 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.246 1.418 . . . . 0.0 111.56 174.069 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.57 -1.36 88.9 Favored Glycine 0 CA--C 1.533 1.213 0 C-N-CA 125.487 1.517 . . . . 0.0 114.849 -177.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -88.67 162.13 16.47 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 119.421 1.61 . . . . 0.0 111.808 175.28 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -89.89 136.44 33.04 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.192 0.997 . . . . 0.0 110.65 176.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -116.79 135.95 53.35 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.255 1.422 . . . . 0.0 110.95 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 22.4 m -132.72 124.26 27.83 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 118.945 0.793 . . . . 0.0 111.869 178.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -100.79 159.56 15.09 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.648 1.579 . . . . 0.0 110.239 169.009 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 35.9 m -116.22 131.36 56.96 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.154 1.381 . . . . 0.0 110.38 177.51 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 50.3 t -117.96 143.26 46.52 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.457 1.903 . . . . 0.0 112.533 176.42 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 68.7 m -142.82 131.12 22.11 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.602 1.161 . . . . 0.0 111.417 177.158 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 -139.87 156.13 46.86 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 126.641 1.977 . . . . 0.0 113.126 177.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.2 t -103.68 134.32 47.22 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.925 1.29 . . . . 0.0 109.438 166.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -147.77 177.11 9.58 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.188 1.795 . . . . 0.0 110.802 -177.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 87.3 m -59.84 135.71 57.78 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.466 1.107 . . . . 0.0 110.18 173.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 44.1 p -72.71 -17.34 61.63 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 114.611 1.337 . . . . 0.0 114.611 -170.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -70.49 -46.0 64.59 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.003 0.921 . . . . 0.0 112.104 179.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 13.0 t -178.14 159.81 1.32 Allowed 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 126.864 2.066 . . . . 0.0 111.243 175.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 51.0 p90 -162.92 157.75 21.54 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.281 1.832 . . . . 0.0 110.855 179.308 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 46.0 t -107.87 136.07 44.46 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 124.887 1.275 . . . . 0.0 108.715 174.202 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -123.25 123.6 41.13 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.313 1.445 . . . . 0.0 108.776 -177.204 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 9.9 m-80 -123.48 152.51 41.63 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.559 1.543 . . . . 0.0 113.153 -167.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 12.6 t90 -117.51 135.71 53.74 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.836 1.654 . . . . 0.0 111.645 175.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -130.69 147.98 52.42 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.239 1.416 . . . . 0.0 113.481 -178.333 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 40.3 ttp180 -100.29 137.26 38.96 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 126.543 1.937 . . . . 0.0 107.331 167.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 16.0 ttm -112.02 134.84 53.33 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.321 1.448 . . . . 0.0 110.423 -175.362 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.1 m -91.4 157.5 42.24 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 124.82 1.248 . . . . 0.0 112.143 178.29 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -56.46 -31.48 85.99 Favored 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 124.209 3.273 . . . . 0.0 114.009 176.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.4 m -76.93 9.77 2.71 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.209 1.404 . . . . 0.0 113.624 177.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 64.2 t30 69.69 26.29 4.97 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 127.104 2.162 . . . . 0.0 112.908 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -94.45 168.36 10.92 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.245 1.018 . . . . 0.0 110.479 172.076 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.0 p -138.81 152.49 47.92 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.069 1.348 . . . . 0.0 111.536 -178.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -133.62 129.93 37.6 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 126.584 1.954 . . . . 0.0 110.105 -178.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -82.95 129.05 34.98 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.863 0.865 . . . . 0.0 111.389 -175.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 55.3 mt -104.21 -50.02 3.45 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.173 0.989 . . . . 0.0 111.963 -171.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -170.25 169.52 7.69 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.611 1.964 . . . . 0.0 109.675 -175.25 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.59 153.27 22.81 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.872 1.269 . . . . 0.0 110.926 -176.074 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -105.48 135.61 19.34 Favored Pre-proline 0 CA--C 1.547 0.846 0 C-N-CA 123.972 0.909 . . . . 0.0 110.994 174.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -68.29 148.23 82.51 Favored 'Cis proline' 0 C--N 1.352 0.727 0 CA-C-N 119.395 0.819 . . . . 0.0 111.102 -6.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -78.4 94.64 4.92 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.845 0.831 . . . . 0.0 111.857 -172.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 53.7 t0 -103.84 97.0 7.07 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.626 1.57 . . . . 0.0 108.314 168.488 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 15.7 mmt85 -76.71 4.16 10.14 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -175.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 60.3 p -81.13 -14.29 57.84 Favored 'General case' 0 CA--C 1.547 0.846 0 O-C-N 121.266 -0.896 . . . . 0.0 112.144 167.628 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 60.3 mm-40 -85.2 167.3 26.53 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 125.178 1.391 . . . . 0.0 111.244 175.545 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -61.71 -0.37 1.5 Allowed 'Trans proline' 0 C--N 1.354 0.836 0 C-N-CA 124.529 3.486 . . . . 0.0 116.802 176.382 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -90.12 61.22 3.34 Favored Glycine 0 C--N 1.338 0.645 0 C-N-CA 125.418 1.485 . . . . 0.0 109.441 171.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 5.1 tp60 -135.61 114.02 11.61 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.12 0.968 . . . . 0.0 111.313 -175.217 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -142.98 150.18 39.32 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.251 1.821 . . . . 0.0 110.073 168.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 75.3 m -70.29 -24.33 63.01 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 114.446 1.276 . . . . 0.0 114.446 -177.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.4 ptp180 -102.66 -21.11 14.18 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 114.71 1.374 . . . . 0.0 114.71 -171.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -103.18 147.98 26.34 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.209 1.404 . . . . 0.0 111.968 -172.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -143.24 151.98 41.19 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.852 1.661 . . . . 0.0 111.989 172.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 46.2 t -121.32 128.56 75.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 124.414 1.085 . . . . 0.0 110.139 169.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 91.5 m -122.96 132.4 54.14 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.137 1.375 . . . . 0.0 110.312 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 24.8 tt0 -86.78 139.08 31.06 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.978 0.911 . . . . 0.0 110.722 173.26 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 28.7 mt -92.46 158.29 38.86 Favored Pre-proline 0 CA--C 1.546 0.794 0 C-N-CA 124.897 1.279 . . . . 0.0 111.808 177.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -67.72 -1.81 7.42 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 123.648 2.899 . . . . 0.0 114.235 175.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 25.3 m120 -64.81 -16.78 63.54 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 172.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 105.44 -34.0 6.11 Favored Glycine 0 N--CA 1.474 1.216 0 C-N-CA 126.127 1.822 . . . . 0.0 114.293 170.009 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 35.0 ptt180 -154.58 73.59 0.91 Allowed 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 123.098 1.428 . . . . 0.0 110.813 169.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -151.83 137.69 18.05 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 127.761 2.425 . . . . 0.0 106.958 179.32 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 -139.81 139.52 36.39 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -167.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -103.55 130.68 51.0 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.836 1.254 . . . . 0.0 111.71 170.51 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -107.04 105.4 15.4 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 127.276 2.23 . . . . 0.0 108.966 179.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 30.2 t -107.6 123.92 49.19 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.727 0.811 . . . . 0.0 112.705 -170.23 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 12.1 t -95.25 119.86 43.88 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 126.355 1.862 . . . . 0.0 106.928 169.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 81.3 t -91.43 128.54 43.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 123.558 0.743 . . . . 0.0 109.876 175.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 69.9 ttt180 53.46 60.55 3.63 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.911 1.684 . . . . 0.0 111.604 174.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.06 134.67 52.32 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.735 0.814 . . . . 0.0 111.362 -172.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.22 167.28 10.68 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.615 1.566 . . . . 0.0 110.261 -179.439 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 88.4 mtm-85 -56.88 -27.75 60.94 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 120.96 -1.088 . . . . 0.0 113.205 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -56.43 -27.77 57.58 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 126.673 1.989 . . . . 0.0 114.527 169.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 -86.95 -14.47 41.7 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 -175.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 52.7 m -59.36 129.88 44.19 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.793 1.179 . . . . 0.0 112.066 175.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 164.46 -159.7 32.67 Favored Glycine 0 N--CA 1.472 1.09 0 O-C-N 121.792 -0.567 . . . . 0.0 113.727 -176.2 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 8.5 m -100.65 144.42 29.65 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.107 1.363 . . . . 0.0 109.983 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 -143.62 155.43 44.26 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.653 1.581 . . . . 0.0 111.551 -178.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.3 pp -157.12 164.91 37.35 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.891 1.276 . . . . 0.0 112.525 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 21.2 t -113.78 155.51 25.52 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.282 1.433 . . . . 0.0 111.052 -179.382 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -154.67 144.23 10.89 Favored Glycine 0 N--CA 1.471 0.995 0 O-C-N 121.304 -0.873 . . . . 0.0 114.297 177.076 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -132.2 158.2 42.35 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -173.562 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 17.0 tt -152.34 134.97 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 125.316 1.446 . . . . 0.0 111.17 178.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 60.9 m -72.9 161.64 30.46 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.108 1.363 . . . . 0.0 113.417 177.324 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -59.73 -21.56 60.85 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 116.122 1.897 . . . . 0.0 116.122 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -72.92 147.73 88.84 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 124.399 1.08 . . . . 0.0 112.653 -173.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -67.22 -20.2 49.67 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.085 2.523 . . . . 0.0 112.75 176.469 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 82.7 tttt -75.82 -13.07 60.28 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 124.801 1.241 . . . . 0.0 113.558 174.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.11 161.64 26.45 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.533 1.133 . . . . 0.0 113.033 -177.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -147.98 152.76 38.04 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.914 1.686 . . . . 0.0 108.631 175.148 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 36.2 mt -71.69 115.39 11.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 O-C-N 121.695 -0.628 . . . . 0.0 110.63 -176.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 48.1 tttp -90.63 141.8 28.41 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.829 1.252 . . . . 0.0 109.661 169.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -110.87 151.01 28.35 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.69 1.196 . . . . 0.0 111.96 -175.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 59.8 p -86.4 176.95 7.6 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.815 1.246 . . . . 0.0 113.275 174.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 99.1 mt -68.65 139.95 55.47 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 166.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.63 148.97 33.02 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 -178.33 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -123.76 169.64 11.32 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 127.182 2.193 . . . . 0.0 111.243 177.266 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -119.74 141.7 49.2 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.981 1.312 . . . . 0.0 112.37 179.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 52.2 tp -109.69 137.8 46.98 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 125.817 1.647 . . . . 0.0 109.752 169.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -128.84 125.01 36.81 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.604 1.562 . . . . 0.0 110.31 173.078 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 40.6 t -108.13 112.44 40.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 C-N-CA 125.224 1.409 . . . . 0.0 108.597 169.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 64.6 p -91.59 154.93 18.72 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.573 1.549 . . . . 0.0 110.241 177.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -58.88 151.0 22.63 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.754 0.822 . . . . 0.0 112.693 -175.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 22.9 tpt180 -61.0 119.28 7.99 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.895 1.278 . . . . 0.0 109.893 -176.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -71.9 141.7 49.52 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 122.953 0.501 . . . . 0.0 111.805 -169.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -69.96 154.32 42.1 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.584 1.154 . . . . 0.0 112.906 177.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 . . . . . 0 C--O 1.253 1.241 0 C-N-CA 127.213 2.205 . . . . 0.0 113.394 177.261 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.552 0 CA-C-O 116.277 -1.821 . . . . 0.0 112.389 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -68.93 156.52 65.1 Favored 'Trans proline' 0 CA--C 1.544 0.989 0 C-N-CA 122.461 2.108 . . . . 0.0 110.96 174.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -64.58 114.73 2.84 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 124.05 3.166 . . . . 0.0 111.832 -173.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.0 t -156.76 154.44 29.98 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.881 1.672 . . . . 0.0 111.568 -178.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -134.34 125.66 28.08 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.964 1.706 . . . . 0.0 109.704 -173.073 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 91.0 p -140.87 157.49 67.34 Favored Pre-proline 0 CA--C 1.549 0.909 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 -169.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -68.32 162.17 80.04 Favored 'Cis proline' 0 C--N 1.355 0.92 0 CA-C-N 119.474 0.848 . . . . 0.0 111.862 -4.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.82 -26.52 68.17 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 176.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 48.0 tp -141.81 123.28 14.95 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.493 1.517 . . . . 0.0 108.889 170.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 53.7 tp -108.79 125.1 51.58 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.3 1.44 . . . . 0.0 109.34 172.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.2 t -110.4 121.39 63.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 124.165 0.986 . . . . 0.0 108.967 175.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.5 m -125.46 172.15 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 C-N-CA 125.009 1.323 . . . . 0.0 111.972 173.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 9.5 m -96.94 151.86 19.28 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 125.789 1.636 . . . . 0.0 110.612 176.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -45.71 122.81 3.9 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.536 1.134 . . . . 0.0 112.525 169.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.57 3.21 88.53 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 125.502 1.525 . . . . 0.0 114.508 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 31.2 t0 -90.4 159.12 16.75 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 119.393 1.597 . . . . 0.0 112.375 177.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 70.2 m-20 -88.96 117.57 28.07 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.345 1.058 . . . . 0.0 110.369 176.506 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -99.19 130.07 45.47 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.856 1.262 . . . . 0.0 110.547 178.22 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 60.9 m -131.92 127.2 35.93 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 119.347 0.976 . . . . 0.0 111.41 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -101.3 158.44 16.05 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.135 1.774 . . . . 0.0 110.474 172.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 37.5 m -106.69 131.23 54.06 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.322 1.449 . . . . 0.0 109.28 173.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 48.5 t -111.69 129.74 56.01 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.902 1.281 . . . . 0.0 110.893 169.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 8.4 t -122.46 131.22 53.76 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.537 1.135 . . . . 0.0 108.666 173.078 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 41.3 p90 -160.73 156.28 25.12 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.442 1.097 . . . . 0.0 112.291 -176.188 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 31.6 m -131.84 115.19 15.61 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.556 1.142 . . . . 0.0 109.013 169.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -84.74 178.01 7.81 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 -173.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 23.6 m -58.2 -61.5 2.51 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 126.203 1.801 . . . . 0.0 113.18 -169.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 75.3 p -176.63 166.56 2.65 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.961 1.304 . . . . 0.0 112.791 -173.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 71.4 -67.07 0.27 Allowed 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 128.429 2.691 . . . . 0.0 113.69 169.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 32.9 t 176.3 160.49 0.33 Allowed 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 129.229 3.011 . . . . 0.0 108.222 -170.234 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 28.5 p90 -150.74 162.44 40.71 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 114.718 1.377 . . . . 0.0 114.718 -169.154 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 64.5 t -105.88 129.48 58.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 126.529 1.932 . . . . 0.0 107.017 167.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 51.3 tp -99.32 143.21 29.84 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.94 1.296 . . . . 0.0 109.453 173.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -138.62 154.56 48.67 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.507 1.523 . . . . 0.0 111.032 -176.706 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 14.9 t90 -128.74 135.66 49.51 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.019 1.328 . . . . 0.0 110.744 175.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 57.8 m-85 -129.06 148.9 51.05 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.95 1.3 . . . . 0.0 113.596 -174.001 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 55.3 ttt-85 -109.03 142.99 38.92 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.694 1.598 . . . . 0.0 108.257 167.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 30.1 mtp -85.77 145.88 27.04 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 118.948 0.794 . . . . 0.0 112.509 176.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 69.1 m -94.07 157.66 37.42 Favored Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 125.494 1.518 . . . . 0.0 111.37 173.618 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -66.71 -16.72 51.2 Favored 'Trans proline' 0 CA--C 1.54 0.825 0 C-N-CA 123.256 2.637 . . . . 0.0 113.383 176.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 40.7 p -76.98 -1.15 27.26 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.118 1.767 . . . . 0.0 113.783 169.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 70.15 20.98 6.15 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 127.849 2.46 . . . . 0.0 113.08 -172.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -88.53 -172.68 3.85 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.423 1.089 . . . . 0.0 110.175 168.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.0 p -142.76 151.49 41.29 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.83 1.652 . . . . 0.0 110.728 -176.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -128.96 133.41 47.8 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 124.645 1.178 . . . . 0.0 111.616 174.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -78.15 129.22 34.9 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.43 1.092 . . . . 0.0 111.472 -179.158 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 57.9 mt -105.57 -47.75 3.84 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 125.575 1.55 . . . . 0.0 112.345 -169.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -162.04 170.02 19.99 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 127.072 2.149 . . . . 0.0 109.68 -174.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.55 171.52 19.5 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.41 1.084 . . . . 0.0 112.042 -172.291 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -146.79 111.45 4.17 Favored Pre-proline 0 CA--C 1.546 0.799 0 C-N-CA 125.026 1.33 . . . . 0.0 109.462 171.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -64.85 155.83 75.8 Favored 'Cis proline' 0 CA--C 1.54 0.794 0 CA-C-N 119.641 0.908 . . . . 0.0 111.721 -5.468 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -76.37 130.73 38.49 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.391 0.677 . . . . 0.0 112.701 -178.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 35.0 m-20 -90.94 1.77 56.77 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.108 1.363 . . . . 0.0 112.593 169.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 57.4 mtm180 -76.03 14.21 0.74 Allowed 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 127.022 2.129 . . . . 0.0 115.722 -168.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 29.4 m -69.73 -24.08 63.49 Favored 'General case' 0 CA--C 1.545 0.755 0 O-C-N 121.215 -0.928 . . . . 0.0 111.796 168.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -77.61 152.56 80.83 Favored Pre-proline 0 CA--C 1.548 0.872 0 C-N-CA 125.078 1.351 . . . . 0.0 110.894 169.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -69.93 156.23 63.42 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 123.145 2.563 . . . . 0.0 112.345 -179.278 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 108.42 14.13 17.11 Favored Glycine 0 CA--C 1.535 1.285 0 C-N-CA 125.004 1.287 . . . . 0.0 114.449 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -82.56 170.86 14.72 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.247 1.419 . . . . 0.0 112.412 174.18 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -142.83 139.43 30.9 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.912 1.285 . . . . 0.0 111.414 175.279 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 16.4 m -66.75 -19.0 65.66 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 115.268 1.581 . . . . 0.0 115.268 -169.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 82.0 mtt85 -60.77 -44.95 96.1 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -91.34 131.56 36.76 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 -164.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 21.4 ttm-85 -144.49 143.99 31.13 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.497 1.119 . . . . 0.0 112.352 169.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 91.8 t -107.3 131.31 57.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 126.638 1.975 . . . . 0.0 109.035 173.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 90.0 m -130.58 133.27 46.05 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.32 1.448 . . . . 0.0 110.686 -178.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -79.08 141.79 37.04 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.165 0.986 . . . . 0.0 112.318 178.095 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 26.6 mt -92.88 162.4 28.95 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 123.543 0.737 . . . . 0.0 111.628 171.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -58.04 -21.03 48.32 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 123.924 3.083 . . . . 0.0 114.093 172.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.409 HD22 ' HB2' ' A' ' 105' ' ' ASP . 41.1 t30 -64.99 -13.83 58.77 Favored 'General case' 0 CA--C 1.552 1.02 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 -179.325 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 83.08 -34.01 2.86 Favored Glycine 0 N--CA 1.475 1.281 0 C-N-CA 125.882 1.706 . . . . 0.0 114.649 171.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 23.0 ptt180 -130.17 73.5 1.54 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 125.391 1.476 . . . . 0.0 109.523 169.36 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.409 ' HB2' HD22 ' A' ' 102' ' ' ASN . 0.3 OUTLIER -178.78 140.68 0.18 Allowed 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 127.569 2.348 . . . . 0.0 109.338 -177.364 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -147.3 153.64 39.97 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.316 1.046 . . . . 0.0 112.79 -168.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -106.91 139.51 41.21 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.609 1.564 . . . . 0.0 111.464 169.167 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.4 mpt? -120.1 106.11 11.66 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 126.471 1.908 . . . . 0.0 109.05 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 77.8 p -108.75 128.26 54.72 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.872 0.869 . . . . 0.0 113.333 -172.042 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 32.5 t -100.14 99.07 7.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 127.859 2.463 . . . . 0.0 106.846 169.107 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 29.2 m -74.46 139.77 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 O-C-N 121.749 -0.595 . . . . 0.0 111.861 178.456 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 32.2 ttm180 53.84 49.51 18.96 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.81 1.644 . . . . 0.0 112.626 170.265 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.5 148.56 50.4 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.195 0.998 . . . . 0.0 112.778 -171.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -124.32 164.73 19.0 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.836 1.254 . . . . 0.0 111.856 178.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 86.5 mtm-85 -52.58 -37.21 57.58 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.401 1.081 . . . . 0.0 113.557 -172.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -48.43 -34.31 10.77 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.859 2.064 . . . . 0.0 114.599 171.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -81.51 -13.91 57.57 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.504 1.122 . . . . 0.0 112.738 -168.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.8 m -59.92 131.1 49.82 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.307 1.043 . . . . 0.0 112.474 179.127 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 161.46 -166.83 36.08 Favored Glycine 0 N--CA 1.473 1.134 0 C-N-CA 124.418 1.008 . . . . 0.0 113.622 -171.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 7.6 m -96.62 140.0 31.88 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.28 1.032 . . . . 0.0 110.816 -175.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 64.8 m-85 -136.44 156.73 48.21 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.004 1.722 . . . . 0.0 111.704 179.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -156.59 150.89 25.34 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 176.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 52.1 t -95.04 151.62 19.03 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 126.486 1.914 . . . . 0.0 111.437 177.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -164.1 138.07 5.09 Favored Glycine 0 N--CA 1.472 1.069 0 O-C-N 121.424 -0.797 . . . . 0.0 114.538 172.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -121.27 159.2 26.48 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.474 1.11 . . . . 0.0 112.644 -178.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 21.2 tt -147.57 135.9 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 125.586 1.554 . . . . 0.0 111.249 -176.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 36.8 t -72.25 161.17 31.23 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.044 0.937 . . . . 0.0 113.46 -178.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 65.7 mt -82.83 -11.45 58.23 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.735 1.214 . . . . 0.0 112.693 169.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -68.73 157.23 89.17 Favored Pre-proline 0 CA--C 1.551 1.018 0 C-N-CA 125.067 1.347 . . . . 0.0 112.358 176.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -66.97 -21.82 49.18 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 122.968 2.445 . . . . 0.0 113.192 178.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.52 6.28 15.3 Favored 'General case' 0 CA--C 1.551 0.994 0 N-CA-C 114.817 1.414 . . . . 0.0 114.817 177.149 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -62.62 159.22 16.44 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.755 1.391 . . . . 0.0 114.755 -171.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -157.23 149.13 22.5 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 127.091 2.156 . . . . 0.0 108.29 -176.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 11.7 mm -71.44 107.6 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 171.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -82.31 88.42 6.54 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.954 0.902 . . . . 0.0 109.308 173.249 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -69.97 134.68 48.61 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.116 0.966 . . . . 0.0 111.37 -178.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 68.7 m -84.74 155.95 21.65 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.155 0.982 . . . . 0.0 112.338 171.457 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -59.82 128.26 36.02 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 121.694 -0.629 . . . . 0.0 109.426 169.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -69.67 157.99 36.21 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 114.371 1.249 . . . . 0.0 114.371 -170.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -127.77 164.41 22.21 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.791 2.037 . . . . 0.0 111.639 176.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -116.24 140.35 49.41 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.767 1.227 . . . . 0.0 111.542 177.354 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 62.1 tp -106.97 134.63 49.83 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.983 1.713 . . . . 0.0 109.563 169.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 59.7 ttt85 -126.92 122.67 35.25 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 125.652 1.581 . . . . 0.0 109.786 170.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 36.4 t -107.46 115.99 49.99 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 C-N-CA 124.866 1.266 . . . . 0.0 108.626 171.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 23.6 p -87.92 161.72 17.3 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.858 1.263 . . . . 0.0 110.925 -179.506 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -58.13 153.01 15.65 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 122.879 0.471 . . . . 0.0 110.376 168.295 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 17.2 mtt180 -67.22 106.83 2.14 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 123.448 0.699 . . . . 0.0 110.011 176.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.77 152.47 39.03 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.267 1.027 . . . . 0.0 111.989 -173.755 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -72.05 154.39 41.16 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.522 1.129 . . . . 0.0 112.586 175.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 . . . . . 0 N--CA 1.485 1.285 0 C-N-CA 127.228 2.211 . . . . 0.0 113.383 177.105 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 56.8 mtt . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 116.572 -1.68 . . . . 0.0 112.494 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -69.87 164.2 35.52 Favored 'Trans proline' 0 C--N 1.357 1.02 0 C-N-CA 122.808 2.339 . . . . 0.0 112.2 -179.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -59.46 143.71 99.62 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 123.578 2.852 . . . . 0.0 115.667 -174.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 15.2 t -143.08 160.15 40.92 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 126.468 1.907 . . . . 0.0 110.197 169.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -148.38 121.78 9.06 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.019 1.328 . . . . 0.0 111.075 -169.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 89.8 p -140.94 160.23 59.1 Favored Pre-proline 0 CA--C 1.55 0.981 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -172.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -68.49 162.55 79.94 Favored 'Cis proline' 0 C--N 1.354 0.825 0 CA-C-N 119.883 0.994 . . . . 0.0 111.482 -7.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.6 -30.74 71.57 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 174.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 33.1 tp -135.46 123.37 22.63 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.739 1.615 . . . . 0.0 109.061 171.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 57.6 tp -107.49 126.6 52.72 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.587 1.155 . . . . 0.0 109.358 169.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.4 t -110.2 124.32 66.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 124.011 0.924 . . . . 0.0 108.916 173.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.6 m -128.24 167.29 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 124.904 1.282 . . . . 0.0 111.938 173.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 51.4 m -93.62 148.92 21.66 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.571 1.148 . . . . 0.0 110.466 175.274 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -53.97 119.33 4.89 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.414 1.486 . . . . 0.0 112.103 178.227 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.04 -0.43 78.9 Favored Glycine 0 CA--C 1.532 1.124 0 C-N-CA 126.21 1.862 . . . . 0.0 115.057 -178.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 40.6 t0 -86.15 158.73 19.7 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 119.11 1.455 . . . . 0.0 111.223 171.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 12.1 p30 -80.85 150.84 28.96 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-O 121.911 0.862 . . . . 0.0 111.453 169.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -133.38 122.59 23.99 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.125 1.77 . . . . 0.0 110.576 -173.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 28.0 m -129.38 126.86 39.82 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 118.832 0.742 . . . . 0.0 111.854 -176.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -101.95 157.07 17.13 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.212 1.805 . . . . 0.0 109.817 169.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 31.6 m -106.35 123.78 48.58 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.944 1.298 . . . . 0.0 109.553 175.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 44.8 t -107.08 134.76 49.73 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.657 1.183 . . . . 0.0 109.735 168.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 9.2 m -133.72 128.82 35.72 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.7 0.8 . . . . 0.0 110.222 -174.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -158.93 153.56 24.48 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.373 1.069 . . . . 0.0 111.595 173.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 63.7 m -83.4 101.57 11.45 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.409 0.623 . . . . 0.0 112.109 -176.24 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 19.7 m120 -69.6 130.54 42.71 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.224 1.009 . . . . 0.0 111.481 178.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 70.5 p -104.78 -169.54 1.63 Allowed 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.747 1.619 . . . . 0.0 111.036 -178.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 36.5 p -73.08 -6.54 46.32 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.9 1.28 . . . . 0.0 113.827 170.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -82.45 110.18 17.34 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.702 1.201 . . . . 0.0 109.478 174.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 15.1 m -59.81 138.62 57.74 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.65 1.58 . . . . 0.0 112.285 -178.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 32.9 p90 -149.33 168.29 23.75 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 115.154 1.538 . . . . 0.0 115.154 -167.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 58.2 t -124.33 135.29 64.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 127.49 2.316 . . . . 0.0 106.981 167.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 29.3 tp -99.39 138.7 36.11 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.509 0.724 . . . . 0.0 109.924 172.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.507 HD21 HG22 ' A' ' 126' ' ' ILE . 7.2 m-80 -130.93 159.19 38.17 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.818 1.247 . . . . 0.0 111.483 -172.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 9.0 t90 -125.84 138.21 53.8 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.312 1.045 . . . . 0.0 111.979 177.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -131.15 144.7 51.57 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.777 1.231 . . . . 0.0 112.796 -176.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -106.78 142.61 36.14 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.45 1.5 . . . . 0.0 108.54 168.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 26.1 mtp -83.29 143.91 30.07 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.95 0.795 . . . . 0.0 112.461 175.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 69.0 m -105.69 148.55 36.63 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 125.47 1.508 . . . . 0.0 111.081 176.028 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -68.05 -16.04 44.24 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 123.977 3.118 . . . . 0.0 114.024 -173.236 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 17.5 m -76.91 8.61 3.59 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.812 1.245 . . . . 0.0 113.206 171.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 57.6 t30 71.31 46.07 0.45 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 127.805 2.442 . . . . 0.0 111.466 -177.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -131.38 -172.66 2.9 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.669 1.588 . . . . 0.0 110.27 -178.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.7 p -144.47 149.18 35.56 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.964 1.706 . . . . 0.0 110.526 -176.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -125.28 134.65 52.2 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.106 1.362 . . . . 0.0 111.314 176.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -78.84 133.0 37.04 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.988 0.915 . . . . 0.0 111.517 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 53.5 mt -107.65 -46.77 3.75 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.767 1.227 . . . . 0.0 112.714 -169.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -169.79 169.42 8.42 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.73 2.012 . . . . 0.0 110.482 -172.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -157.25 162.01 39.22 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.861 1.265 . . . . 0.0 113.163 -179.226 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -139.92 122.5 10.12 Favored Pre-proline 0 CA--C 1.547 0.839 0 C-N-CA 126.326 1.851 . . . . 0.0 110.1 174.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_exo -53.92 157.27 14.96 Favored 'Cis proline' 0 C--N 1.351 0.661 0 CA-C-N 120.56 1.236 . . . . 0.0 113.719 -7.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -62.79 115.08 4.03 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.182 0.993 . . . . 0.0 113.533 -169.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -85.12 7.55 21.29 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 125.521 1.528 . . . . 0.0 111.957 169.172 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.3 tpm_? -53.05 -38.01 62.09 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 127.912 2.485 . . . . 0.0 113.05 178.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.5 t 75.01 -54.65 0.66 Allowed 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 127.578 2.351 . . . . 0.0 113.283 175.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -135.79 148.7 66.36 Favored Pre-proline 0 CA--C 1.546 0.813 0 C-N-CA 124.873 1.269 . . . . 0.0 112.19 -175.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -82.18 174.21 10.2 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 124.436 3.424 . . . . 0.0 111.349 174.105 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 88.8 9.36 68.48 Favored Glycine 0 CA--C 1.531 1.033 0 C-N-CA 124.108 0.861 . . . . 0.0 112.983 -179.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -151.89 138.54 18.76 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.335 1.854 . . . . 0.0 109.25 -178.385 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 15.5 t0 -142.95 137.0 29.1 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.301 1.44 . . . . 0.0 111.007 -179.242 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 84.3 p -94.23 -9.1 37.31 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.801 1.24 . . . . 0.0 113.69 176.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 41.3 mtm180 77.77 -27.05 0.17 Allowed 'General case' 0 C--N 1.346 0.436 0 C-N-CA 131.184 3.793 . . . . 0.0 113.845 -176.59 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -67.22 142.11 57.06 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.548 1.539 . . . . 0.0 110.968 168.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 85.0 mtm180 -143.85 148.75 35.94 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.997 1.719 . . . . 0.0 111.281 -174.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.435 HG22 ' SD ' ' A' ' 108' ' ' MET . 40.2 t -126.49 126.33 68.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 125.451 1.5 . . . . 0.0 108.452 171.591 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 87.9 m -130.61 130.52 44.1 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.075 0.95 . . . . 0.0 110.996 178.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 65.4 tt0 -82.85 135.08 35.05 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 118.658 0.663 . . . . 0.0 110.042 169.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 37.1 mt -91.85 158.94 39.13 Favored Pre-proline 0 CA--C 1.543 0.681 0 C-N-CA 124.112 0.965 . . . . 0.0 112.205 -172.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -63.92 -6.88 11.9 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 123.64 2.893 . . . . 0.0 114.02 174.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -63.32 -26.15 68.63 Favored 'General case' 0 CA--C 1.55 0.974 0 CA-C-N 119.462 1.028 . . . . 0.0 112.155 168.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 91.19 -34.08 4.44 Favored Glycine 0 CA--C 1.531 1.037 0 C-N-CA 126.717 2.103 . . . . 0.0 113.938 175.155 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -126.84 73.44 1.41 Allowed 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.917 1.287 . . . . 0.0 109.48 171.376 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -178.37 146.0 0.36 Allowed 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 126.396 1.878 . . . . 0.0 110.742 -177.416 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -145.83 139.8 26.62 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.031 0.933 . . . . 0.0 111.773 -170.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -98.91 131.03 45.3 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.403 1.081 . . . . 0.0 111.85 169.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.435 ' SD ' HG22 ' A' ' 97' ' ' VAL . 20.8 mmt -108.98 103.24 12.23 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.983 2.113 . . . . 0.0 107.726 174.516 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 22.8 t -121.46 125.55 47.16 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 114.9 1.444 . . . . 0.0 114.9 -167.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 3.7 t -92.35 123.24 44.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 125.244 1.417 . . . . 0.0 108.229 168.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 87.6 t -82.89 128.4 38.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 168.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 44.3 ttt85 56.78 69.67 0.72 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.787 1.235 . . . . 0.0 112.07 171.03 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -74.35 134.48 42.5 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.409 1.083 . . . . 0.0 111.508 -177.324 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -108.63 163.03 13.6 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.032 1.733 . . . . 0.0 109.666 174.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 64.6 mtp85 -56.83 -28.01 60.94 Favored 'General case' 0 N--CA 1.478 0.947 0 O-C-N 121.021 -1.049 . . . . 0.0 113.74 179.116 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -61.46 -16.72 49.79 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.306 1.443 . . . . 0.0 114.623 171.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -89.68 -12.84 38.35 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.218 1.407 . . . . 0.0 113.634 178.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 48.1 m -64.74 138.16 58.22 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 120.815 -1.178 . . . . 0.0 112.132 -178.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 149.2 -165.8 29.43 Favored Glycine 0 N--CA 1.474 1.192 0 C-N-CA 124.13 0.871 . . . . 0.0 113.592 -176.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.5 m -91.23 142.66 27.48 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.165 1.386 . . . . 0.0 111.284 -174.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -138.78 160.82 38.76 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.678 1.991 . . . . 0.0 111.745 -178.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -156.29 147.12 21.96 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.603 1.161 . . . . 0.0 113.355 173.517 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 51.4 t -84.16 150.44 25.51 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.341 1.857 . . . . 0.0 110.704 173.156 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -161.43 129.52 2.13 Favored Glycine 0 N--CA 1.474 1.172 0 O-C-N 121.184 -0.947 . . . . 0.0 114.4 174.209 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -90.66 159.26 16.49 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.151 0.981 . . . . 0.0 112.197 178.638 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.507 HG22 HD21 ' A' ' 66' ' ' ASN . 17.2 tt -146.39 138.67 19.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 124.702 1.201 . . . . 0.0 109.781 170.515 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 7.3 m -81.11 161.48 24.1 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.763 0.825 . . . . 0.0 112.384 179.609 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 55.9 mt -78.6 -12.51 60.02 Favored 'General case' 0 N--CA 1.476 0.875 0 N-CA-C 114.115 1.154 . . . . 0.0 114.115 178.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -67.03 148.19 98.93 Favored Pre-proline 0 CA--C 1.553 1.064 0 C-N-CA 124.12 0.968 . . . . 0.0 112.532 179.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -55.96 -28.79 70.46 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 123.598 2.865 . . . . 0.0 114.601 176.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -85.14 4.42 34.45 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.747 1.219 . . . . 0.0 114.227 -179.063 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -63.09 159.17 17.88 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.99 1.108 . . . . 0.0 113.99 -176.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -150.63 166.54 30.02 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.73 2.012 . . . . 0.0 109.005 174.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 51.0 mt -73.11 114.16 12.05 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-O 121.584 0.707 . . . . 0.0 109.918 -178.155 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -81.47 88.37 6.16 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.991 1.716 . . . . 0.0 107.917 169.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -75.4 141.73 43.18 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.136 0.975 . . . . 0.0 112.354 -171.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 6.9 t -91.35 178.64 5.91 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.803 1.241 . . . . 0.0 111.848 169.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.6 pp -76.35 159.05 30.88 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.868 0.867 . . . . 0.0 112.061 174.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 91.0 mtm180 -83.58 150.54 25.87 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.251 1.02 . . . . 0.0 113.038 -174.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -136.93 169.62 17.47 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 127.164 2.186 . . . . 0.0 109.693 169.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -132.57 147.57 52.35 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 177.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 63.6 tp -107.41 134.46 50.42 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 126.982 2.113 . . . . 0.0 109.954 177.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 69.5 ttt180 -122.62 121.55 36.7 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 125.938 1.695 . . . . 0.0 109.885 171.393 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 44.2 t -103.39 117.6 49.09 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.704 1.202 . . . . 0.0 108.848 170.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 74.4 p -96.54 150.97 20.03 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.578 1.551 . . . . 0.0 110.24 177.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -64.03 142.74 58.3 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.328 0.585 . . . . 0.0 111.851 -178.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 54.1 ttp180 -78.14 116.81 18.87 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.782 0.833 . . . . 0.0 110.147 179.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 6.5 ppt_? -72.86 163.6 27.89 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.17 0.988 . . . . 0.0 112.771 -178.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -68.03 150.4 48.49 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.35 1.06 . . . . 0.0 112.592 177.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 . . . . . 0 C--O 1.253 1.259 0 N-CA-C 114.925 1.454 . . . . 0.0 114.925 -177.205 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . 0.463 ' N ' ' HG ' ' A' ' 57' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.487 0 CA-C-O 118.611 -0.709 . . . . 0.0 111.586 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -57.35 153.38 40.86 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 123.888 3.059 . . . . 0.0 113.337 178.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -73.24 118.02 5.35 Favored 'Trans proline' 0 N--CA 1.459 -0.538 0 C-N-CA 123.759 2.973 . . . . 0.0 110.531 176.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 66.6 p -129.0 157.47 41.61 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.264 1.026 . . . . 0.0 112.043 -176.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -144.14 124.66 13.98 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.043 1.737 . . . . 0.0 108.869 178.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 78.9 p -140.82 161.15 55.67 Favored Pre-proline 0 CA--C 1.55 0.95 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 -168.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -66.43 163.54 69.51 Favored 'Cis proline' 0 C--N 1.355 0.881 0 CA-C-N 119.572 0.883 . . . . 0.0 111.664 -7.509 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.78 -33.12 71.28 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 174.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.6 tt -136.34 124.32 22.82 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.61 1.564 . . . . 0.0 109.139 171.02 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.4 tp -106.75 130.3 54.49 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.75 1.22 . . . . 0.0 108.948 169.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 12.8 p -113.0 129.92 67.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 C-N-CA 124.007 0.923 . . . . 0.0 109.692 169.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.6 m -131.81 164.76 33.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 125.065 1.346 . . . . 0.0 111.348 174.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 16.8 m -89.87 149.02 22.83 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.553 1.141 . . . . 0.0 110.303 172.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -53.88 121.7 8.5 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.047 1.339 . . . . 0.0 111.015 175.657 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.24 4.12 78.01 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 125.486 1.517 . . . . 0.0 114.894 -176.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -95.71 150.21 20.63 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 119.577 1.688 . . . . 0.0 111.159 169.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -75.41 130.77 39.5 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.267 -0.896 . . . . 0.0 111.543 175.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -101.71 122.08 43.25 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 125.47 1.508 . . . . 0.0 110.174 175.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 60.5 m -128.16 124.35 36.62 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.023 0.929 . . . . 0.0 110.827 -178.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -102.45 159.54 15.34 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 127.21 2.204 . . . . 0.0 110.524 175.265 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 30.7 m -113.21 127.55 56.21 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.956 1.302 . . . . 0.0 110.006 177.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 53.1 t -111.66 142.02 44.51 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.785 1.634 . . . . 0.0 111.854 173.33 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.5 t -138.89 119.32 13.8 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.717 0.807 . . . . 0.0 111.309 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -132.06 156.16 46.79 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 126.235 1.814 . . . . 0.0 113.103 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.463 ' HG ' ' N ' ' A' ' 33' ' ' MET . 86.1 p -138.78 158.04 44.95 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.449 1.9 . . . . 0.0 107.701 166.139 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -147.06 152.02 37.86 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 121.188 -0.945 . . . . 0.0 113.474 -168.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 21.0 p -80.18 -26.66 39.15 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.73 1.612 . . . . 0.0 112.902 178.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 49.5 m -84.27 152.61 24.06 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.487 1.115 . . . . 0.0 111.1 170.269 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -70.17 -11.34 60.83 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.316 1.846 . . . . 0.0 114.653 -176.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 25.8 m -161.37 152.54 18.58 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 126.251 1.821 . . . . 0.0 110.993 176.406 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 55.2 p90 -160.73 159.22 29.88 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.847 1.259 . . . . 0.0 112.396 -173.063 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 90.7 t -95.97 134.77 32.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 125.672 1.589 . . . . 0.0 107.467 169.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.4 tp -99.33 145.84 26.9 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.705 1.202 . . . . 0.0 109.472 170.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -134.92 156.76 48.41 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.844 1.657 . . . . 0.0 111.984 -169.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 22.6 t90 -136.24 138.84 42.24 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.553 1.141 . . . . 0.0 112.103 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 48.6 m-85 -138.9 149.09 44.43 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.818 1.247 . . . . 0.0 114.009 -172.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -109.13 143.36 38.61 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.779 1.631 . . . . 0.0 108.531 167.566 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 31.7 mtp -84.58 143.92 28.98 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 119.437 1.017 . . . . 0.0 112.612 173.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 45.6 m -91.48 158.02 41.31 Favored Pre-proline 0 CA--C 1.548 0.901 0 C-N-CA 124.954 1.302 . . . . 0.0 111.601 173.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_exo -55.5 -32.39 82.3 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 123.983 3.122 . . . . 0.0 114.495 178.373 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.0 m -76.94 5.93 7.11 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 124.892 1.277 . . . . 0.0 113.845 177.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 73.99 20.94 2.71 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 127.828 2.451 . . . . 0.0 113.041 -176.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -89.4 -172.61 3.68 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.585 1.154 . . . . 0.0 110.287 169.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.1 p -144.06 146.96 33.18 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 125.597 1.559 . . . . 0.0 110.521 -176.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -121.96 132.42 54.53 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 125.077 1.351 . . . . 0.0 110.848 175.317 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 33.3 tttm -80.57 117.18 21.05 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.194 1.398 . . . . 0.0 110.9 -177.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 71.7 mt -90.07 -52.72 4.81 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 125.187 1.395 . . . . 0.0 111.253 -172.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -160.74 173.51 15.3 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.84 1.256 . . . . 0.0 111.79 -178.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -156.06 156.4 34.31 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.437 1.495 . . . . 0.0 111.798 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -142.0 129.46 11.5 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 125.004 1.322 . . . . 0.0 110.73 178.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.17 155.84 19.97 Favored 'Cis proline' 0 C--N 1.353 0.766 0 CA-C-N 120.498 1.214 . . . . 0.0 112.825 -8.315 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -58.9 115.26 3.0 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 114.006 1.113 . . . . 0.0 114.006 -168.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -85.93 -0.26 54.97 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.315 1.446 . . . . 0.0 111.777 168.188 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 45.6 ttt85 -66.09 -77.68 0.06 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 127.936 2.494 . . . . 0.0 111.233 -179.081 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 10.9 t 67.44 -59.72 0.4 Allowed 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 127.207 2.203 . . . . 0.0 112.009 -172.079 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -117.99 155.53 51.09 Favored Pre-proline 0 CA--C 1.547 0.84 0 C-N-CA 127.071 2.148 . . . . 0.0 108.166 168.546 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -57.76 116.13 3.01 Favored 'Trans proline' 0 C--N 1.351 0.69 0 C-N-CA 122.874 2.383 . . . . 0.0 113.996 -171.119 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -106.32 -3.55 38.2 Favored Glycine 0 CA--C 1.535 1.293 0 C-N-CA 125.372 1.463 . . . . 0.0 113.037 171.021 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -159.62 159.19 32.85 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 128.106 2.562 . . . . 0.0 109.752 -174.758 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -73.59 159.78 32.61 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.818 0.847 . . . . 0.0 112.032 175.455 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 83.6 p -67.34 -5.8 15.97 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 114.393 1.257 . . . . 0.0 114.393 -177.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 48.1 mtp180 -68.78 -30.53 69.14 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.333 1.453 . . . . 0.0 113.002 173.283 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -97.7 119.71 36.77 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.221 1.409 . . . . 0.0 110.398 -174.07 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -139.48 145.67 39.06 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.416 1.086 . . . . 0.0 112.044 -169.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -126.56 135.95 62.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 125.153 1.381 . . . . 0.0 112.052 170.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 91.8 m -130.5 130.17 43.84 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.446 1.498 . . . . 0.0 110.756 -177.081 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -79.37 134.32 36.58 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.318 1.047 . . . . 0.0 110.371 173.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 36.4 mt -88.27 159.65 47.18 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 123.657 0.783 . . . . 0.0 111.829 178.199 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -63.4 -7.46 12.38 Favored 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 123.563 2.842 . . . . 0.0 113.979 173.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -67.23 -14.5 62.97 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 119.174 0.897 . . . . 0.0 112.946 169.157 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 83.98 -34.08 3.04 Favored Glycine 0 N--CA 1.473 1.123 0 C-N-CA 126.92 2.2 . . . . 0.0 114.343 172.092 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.67 73.59 1.46 Allowed 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 123.733 1.73 . . . . 0.0 109.669 173.349 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -174.89 141.72 0.62 Allowed 'General case' 0 C--O 1.237 0.418 0 C-N-CA 128.51 2.724 . . . . 0.0 108.095 -176.413 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -145.04 149.92 35.96 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.853 1.057 . . . . 0.0 113.853 -167.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -104.06 132.77 49.97 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.805 1.242 . . . . 0.0 110.479 167.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -112.87 123.31 50.02 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 126.652 1.981 . . . . 0.0 108.211 174.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 9.4 t -130.44 133.75 46.58 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 114.257 1.206 . . . . 0.0 114.257 -169.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 61.7 t -105.35 101.92 13.07 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 126.651 1.98 . . . . 0.0 106.817 168.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 98.0 t -73.2 125.53 32.3 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 123.66 0.784 . . . . 0.0 110.649 -177.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 72.3 mtt-85 51.08 70.42 0.53 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.597 1.959 . . . . 0.0 112.034 -177.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -66.34 134.09 51.86 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.79 1.636 . . . . 0.0 111.476 -178.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 8.3 mpt_? -108.38 166.68 10.58 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 126.11 1.764 . . . . 0.0 109.289 172.597 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 35.2 mtp180 -57.22 -30.2 64.39 Favored 'General case' 0 N--CA 1.478 0.962 0 O-C-N 121.033 -1.042 . . . . 0.0 113.619 -174.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -61.68 -19.39 62.29 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.464 1.506 . . . . 0.0 114.756 173.222 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 37.4 m-20 -84.59 -12.83 53.28 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 119.966 1.257 . . . . 0.0 113.481 177.223 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 48.4 m -63.1 143.85 57.42 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.734 1.152 . . . . 0.0 112.597 -179.466 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 143.42 -166.83 26.72 Favored Glycine 0 N--CA 1.474 1.173 0 O-C-N 121.262 -0.898 . . . . 0.0 113.469 -176.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.9 m -91.71 143.59 26.39 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 125.173 1.389 . . . . 0.0 111.08 -172.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -142.19 161.2 38.6 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.09 1.756 . . . . 0.0 111.57 -177.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -161.68 165.12 28.66 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.926 1.29 . . . . 0.0 113.054 177.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 13.6 t -108.79 156.65 19.38 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.974 1.709 . . . . 0.0 111.038 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -144.66 174.6 24.76 Favored Glycine 0 N--CA 1.47 0.959 0 C-N-CA 124.791 1.186 . . . . 0.0 113.436 176.274 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -152.45 159.24 43.39 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.184 0.994 . . . . 0.0 112.934 175.114 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 18.1 tt -152.22 135.01 6.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 125.463 1.505 . . . . 0.0 110.286 174.511 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 58.1 p -72.48 161.51 30.7 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.249 -0.907 . . . . 0.0 113.146 178.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 48.2 mt -75.58 -2.15 27.81 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 -179.029 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -68.07 150.83 97.6 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 124.611 1.164 . . . . 0.0 112.521 177.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_endo -69.51 -23.59 31.75 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.016 2.477 . . . . 0.0 112.787 176.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -91.38 8.1 37.83 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 125.088 1.355 . . . . 0.0 113.717 178.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.14 161.71 18.52 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.743 1.217 . . . . 0.0 113.922 -175.124 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -149.48 151.83 34.6 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.783 1.633 . . . . 0.0 109.251 178.233 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 51.2 mt -76.1 127.78 37.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 123.594 0.758 . . . . 0.0 111.957 -173.174 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -99.35 151.03 21.53 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.126 1.77 . . . . 0.0 109.328 168.097 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -132.54 149.12 52.37 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.27 1.028 . . . . 0.0 111.969 -172.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 60.6 p -87.6 177.85 6.94 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.858 1.263 . . . . 0.0 113.725 175.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -68.38 152.25 45.7 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.636 0.774 . . . . 0.0 109.208 166.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -82.12 152.84 26.36 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.113 0.965 . . . . 0.0 113.332 -177.405 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -124.67 169.66 11.75 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 127.158 2.183 . . . . 0.0 109.932 169.038 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -135.97 151.51 50.01 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 170.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 60.4 tp -112.87 132.91 55.1 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 126.704 2.002 . . . . 0.0 110.543 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 69.9 ttt180 -118.06 118.06 30.89 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.477 1.911 . . . . 0.0 109.663 171.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 42.4 t -102.3 116.67 46.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 123.82 0.848 . . . . 0.0 109.012 169.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 73.7 p -95.96 154.2 17.36 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.967 1.707 . . . . 0.0 110.606 178.251 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -64.61 145.61 55.91 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.641 -0.662 . . . . 0.0 112.32 -178.06 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 38.9 ttt85 -82.71 128.63 34.54 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.476 1.111 . . . . 0.0 110.361 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 36.2 ttp180 -72.16 147.87 46.18 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.532 0.733 . . . . 0.0 111.792 -177.395 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -67.85 154.35 41.75 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 123.99 0.916 . . . . 0.0 111.091 167.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 . . . . . 0 N--CA 1.485 1.296 0 C-N-CA 127.531 2.332 . . . . 0.0 113.242 179.35 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 97.3 mmm . . . . . 0 N--CA 1.49 1.534 0 CA-C-O 118.927 -0.559 . . . . 0.0 110.663 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -69.92 140.43 42.03 Favored 'Trans proline' 0 CA--C 1.543 0.944 0 C-N-CA 122.54 2.16 . . . . 0.0 110.917 178.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -73.26 155.94 51.21 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 123.44 2.76 . . . . 0.0 111.138 174.583 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.8 t -170.16 150.69 3.74 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.771 1.228 . . . . 0.0 111.758 -178.048 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.55 ' CE1' ' HB3' ' A' ' 123' ' ' CYS . 1.0 OUTLIER -125.99 136.52 53.08 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 125.522 1.529 . . . . 0.0 109.674 178.164 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 88.9 p -141.02 156.2 68.44 Favored Pre-proline 0 N--CA 1.478 0.935 0 N-CA-C 114.793 1.405 . . . . 0.0 114.793 -178.732 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -69.52 161.55 85.24 Favored 'Cis proline' 0 C--N 1.352 0.747 0 CA-C-N 119.307 0.788 . . . . 0.0 111.194 -10.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.47 -34.09 73.52 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 172.418 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 31.9 tp -132.83 121.14 22.51 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.757 1.623 . . . . 0.0 109.04 171.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 51.5 tp -105.09 130.38 53.29 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.63 1.172 . . . . 0.0 109.475 170.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.1 t -112.92 124.97 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 123.864 0.865 . . . . 0.0 109.104 173.087 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.3 m -127.22 166.36 24.1 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 C-N-CA 125.03 1.332 . . . . 0.0 111.828 173.417 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 45.4 m -91.47 147.16 23.22 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.337 1.055 . . . . 0.0 110.211 173.384 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 65.1 tt0 -53.96 116.44 2.56 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.79 1.636 . . . . 0.0 112.245 177.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 94.23 3.61 63.28 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 126.365 1.936 . . . . 0.0 114.825 -177.25 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 37.2 t0 -91.2 159.51 16.02 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 119.581 1.69 . . . . 0.0 111.622 172.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -85.32 130.58 34.56 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.224 -0.923 . . . . 0.0 111.373 172.263 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -103.01 133.83 47.47 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.923 1.689 . . . . 0.0 110.745 178.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 27.8 m -132.74 127.98 35.88 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.446 1.099 . . . . 0.0 111.906 178.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -105.36 159.56 15.81 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.222 2.209 . . . . 0.0 110.465 169.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 29.7 m -101.13 140.58 35.23 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.606 1.563 . . . . 0.0 109.182 169.56 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 17.4 t -131.53 131.94 43.78 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.697 1.599 . . . . 0.0 111.594 171.586 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 9.9 m -122.97 132.71 54.27 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.38 1.072 . . . . 0.0 111.109 179.271 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -137.76 156.13 48.3 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 126.168 1.787 . . . . 0.0 113.157 169.455 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 92.7 p -151.11 152.81 33.91 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.684 1.593 . . . . 0.0 109.231 167.345 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 69.8 m-80 -149.06 161.88 41.07 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.738 1.215 . . . . 0.0 112.1 -169.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 17.2 p -66.78 -43.24 84.49 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.375 1.47 . . . . 0.0 111.12 172.571 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 67.7 m -68.81 128.15 35.65 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.957 1.303 . . . . 0.0 110.059 169.036 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -72.13 -4.64 30.26 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.02 1.328 . . . . 0.0 114.281 -172.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 63.4 p -149.41 147.02 27.77 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.168 1.387 . . . . 0.0 112.072 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 38.1 p90 -166.01 159.67 15.81 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.354 1.462 . . . . 0.0 111.809 -171.002 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 30.4 t -95.97 138.27 21.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 125.387 1.475 . . . . 0.0 107.594 170.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 9.0 tt -127.78 131.26 49.64 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.373 1.469 . . . . 0.0 109.583 -177.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -145.66 160.91 41.0 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 115.323 1.601 . . . . 0.0 115.323 -167.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 61.1 t-105 -113.94 148.84 36.16 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 126.585 1.954 . . . . 0.0 112.253 -179.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -141.14 146.63 37.27 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.528 1.531 . . . . 0.0 113.89 -172.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 34.3 ttp-105 -91.21 140.21 30.01 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.887 1.675 . . . . 0.0 108.152 167.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 21.1 mtp -86.6 136.75 32.93 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 119.328 0.967 . . . . 0.0 111.021 168.274 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 68.8 m -106.32 148.67 37.11 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 125.143 1.377 . . . . 0.0 110.986 177.187 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -68.45 -17.6 43.81 Favored 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 124.085 3.19 . . . . 0.0 113.711 -171.065 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.4 m -76.97 21.31 0.22 Allowed 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 125.278 1.431 . . . . 0.0 112.927 170.765 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 64.5 t30 64.35 39.99 6.79 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.685 2.394 . . . . 0.0 112.455 177.447 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -133.05 179.24 6.3 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.139 1.376 . . . . 0.0 111.001 -172.573 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.8 p -137.03 152.51 50.19 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 125.528 1.531 . . . . 0.0 111.043 -177.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -133.33 131.56 40.27 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.747 1.219 . . . . 0.0 110.88 178.373 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 5.4 ttpm? -78.91 132.43 36.75 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.553 0.741 . . . . 0.0 111.876 -173.355 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 83.9 mt -110.49 -46.82 3.35 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 125.038 1.335 . . . . 0.0 112.205 -171.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -152.84 160.02 43.07 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.39 1.076 . . . . 0.0 111.573 -179.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -154.07 149.05 26.74 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.513 1.125 . . . . 0.0 112.977 -172.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -136.02 126.8 16.79 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 125.916 1.686 . . . . 0.0 109.908 169.456 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -54.69 162.88 12.17 Favored 'Cis proline' 0 C--N 1.351 0.709 0 CA-C-N 120.275 1.134 . . . . 0.0 113.278 -10.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -63.96 113.93 3.79 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.754 0.821 . . . . 0.0 112.335 -170.075 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -161.17 41.43 0.15 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.391 1.877 . . . . 0.0 110.589 -173.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -65.07 -38.19 89.99 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 114.165 1.172 . . . . 0.0 114.165 -169.19 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 7.9 m 78.75 -3.89 2.19 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 127.648 2.379 . . . . 0.0 114.271 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.5 pp0? -76.56 162.76 69.56 Favored Pre-proline 0 CA--C 1.551 1.009 0 C-N-CA 124.636 1.174 . . . . 0.0 111.56 173.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -62.1 -4.29 4.88 Favored 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 124.424 3.416 . . . . 0.0 118.544 -170.03 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 89.9 0.69 77.71 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 125.793 1.663 . . . . 0.0 111.649 -170.014 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 19.9 mm100 -88.46 -28.92 20.54 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.464 1.106 . . . . 0.0 113.619 -174.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -82.92 129.22 34.99 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -179.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 8.0 t -118.1 7.83 12.28 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 124.845 1.258 . . . . 0.0 112.716 171.174 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 47.8 mtp180 -84.07 -42.0 16.58 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.421 1.089 . . . . 0.0 112.658 -171.61 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -95.98 133.63 39.97 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.222 1.009 . . . . 0.0 111.083 -176.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 66.2 mtm180 -143.33 152.24 41.41 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.174 0.99 . . . . 0.0 113.105 -171.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.8 t -121.61 130.61 74.45 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 126.483 1.913 . . . . 0.0 108.562 169.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 94.6 m -129.44 135.41 48.63 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 125.17 1.388 . . . . 0.0 110.444 -175.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -76.31 141.75 41.5 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.217 1.007 . . . . 0.0 111.519 178.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 96.4 mt -101.48 157.05 34.4 Favored Pre-proline 0 CA--C 1.542 0.661 0 C-N-CA 124.16 0.984 . . . . 0.0 111.582 170.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -70.39 -2.8 11.21 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 123.537 2.825 . . . . 0.0 113.527 173.573 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -72.46 -6.0 40.63 Favored 'General case' 0 CA--C 1.551 1.019 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -179.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 95.55 -31.92 6.72 Favored Glycine 0 CA--C 1.534 1.266 0 C-N-CA 126.019 1.771 . . . . 0.0 115.27 169.47 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 32.6 ptt180 -154.6 73.76 0.91 Allowed 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.546 1.538 . . . . 0.0 109.905 172.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -167.36 145.47 4.77 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 126.287 1.835 . . . . 0.0 108.925 -169.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -144.42 150.11 37.15 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -168.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -101.1 138.0 38.71 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.239 1.416 . . . . 0.0 110.111 167.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 6.9 mmt -123.51 117.84 26.02 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 126.545 1.938 . . . . 0.0 108.3 -176.002 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 71.0 p -131.27 148.7 52.72 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 115.602 1.704 . . . . 0.0 115.602 -169.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 22.1 t -118.66 102.76 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 C-N-CA 127.478 2.311 . . . . 0.0 107.233 176.55 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 58.6 t -78.02 131.86 33.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 124.006 0.923 . . . . 0.0 110.147 -178.015 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 3.7 tpt180 63.07 53.93 2.22 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.423 1.489 . . . . 0.0 111.198 175.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.43 123.61 22.75 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.573 1.149 . . . . 0.0 111.062 -174.392 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? -106.73 169.76 8.34 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 126.085 1.754 . . . . 0.0 110.295 177.61 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 22.2 mmm180 -49.19 -37.35 22.33 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.61 1.164 . . . . 0.0 113.84 -175.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -60.07 -25.09 65.1 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 125.271 1.429 . . . . 0.0 114.697 175.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 -81.8 -1.87 48.88 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.896 1.278 . . . . 0.0 113.272 178.44 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 33.1 m -70.32 124.04 23.18 Favored 'General case' 0 CA--C 1.543 0.699 0 O-C-N 120.18 -1.575 . . . . 0.0 111.238 173.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 165.96 -171.48 41.08 Favored Glycine 0 N--CA 1.474 1.173 0 O-C-N 121.682 -0.636 . . . . 0.0 114.306 -177.068 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.0 m -88.9 139.72 30.17 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.725 1.21 . . . . 0.0 110.714 -179.254 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -144.2 157.67 44.16 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.046 1.738 . . . . 0.0 111.007 -177.376 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.5 pp -155.16 165.36 36.93 Favored 'General case' 0 N--CA 1.469 0.478 0 O-C-N 121.25 -0.906 . . . . 0.0 113.243 -178.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . 0.55 ' HB3' ' CE1' ' A' ' 37' ' ' PHE . 48.4 t -111.16 156.12 21.88 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.243 1.417 . . . . 0.0 110.574 175.064 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -144.51 167.95 26.89 Favored Glycine 0 CA--C 1.524 0.653 0 C-N-CA 124.496 1.046 . . . . 0.0 112.536 171.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -145.13 149.34 34.83 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.869 0.868 . . . . 0.0 111.844 175.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.4 tt -148.9 133.08 8.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 125.452 1.501 . . . . 0.0 110.842 -176.091 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 14.5 m -66.39 159.58 26.61 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.397 1.079 . . . . 0.0 112.656 179.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 29.4 mt -73.28 -14.38 61.3 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.213 1.19 . . . . 0.0 114.213 -174.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -72.35 143.03 85.09 Favored Pre-proline 0 CA--C 1.552 1.054 0 C-N-CA 124.294 1.037 . . . . 0.0 112.329 177.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -56.22 -27.01 64.07 Favored 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 123.829 3.019 . . . . 0.0 115.153 177.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -78.81 -4.34 48.96 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 -178.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.97 169.49 13.18 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 124.891 1.276 . . . . 0.0 113.766 -176.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -149.76 162.48 40.18 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.157 1.783 . . . . 0.0 110.21 175.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 10.0 mm -73.08 123.44 27.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-O 121.756 0.789 . . . . 0.0 111.757 -178.217 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -84.67 143.29 29.31 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 126.799 2.04 . . . . 0.0 110.171 169.636 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -134.14 158.85 42.6 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.594 1.558 . . . . 0.0 112.188 -172.12 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 5.9 t -140.21 -163.88 1.6 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.784 1.234 . . . . 0.0 111.664 169.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -65.89 114.34 5.04 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.545 1.538 . . . . 0.0 110.424 -178.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 1.4 ptp180 -71.43 154.74 41.31 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 125.372 1.469 . . . . 0.0 112.939 -177.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.89 169.63 9.09 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.633 1.973 . . . . 0.0 111.225 -171.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -136.51 146.84 46.69 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 122.228 1.013 . . . . 0.0 112.956 175.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 58.4 tp -109.69 134.29 52.14 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 127.1 2.16 . . . . 0.0 109.531 179.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 70.6 ttt180 -121.12 123.91 43.46 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 125.937 1.695 . . . . 0.0 109.574 171.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 53.9 t -103.07 120.44 52.93 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 C-N-CA 124.497 1.119 . . . . 0.0 108.132 169.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 54.7 p -93.29 147.53 22.83 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.289 1.436 . . . . 0.0 109.411 174.099 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -59.86 148.07 36.1 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.444 0.698 . . . . 0.0 112.244 -174.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 60.1 ttp180 -58.27 114.37 2.38 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 125.016 1.326 . . . . 0.0 110.199 -170.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 46.6 mtm105 -75.3 153.82 37.71 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.685 -168.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -70.54 154.38 41.94 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.545 1.138 . . . . 0.0 112.424 175.112 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 . . . . . 0 C--O 1.254 1.314 0 C-N-CA 125.27 1.428 . . . . 0.0 112.992 177.16 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 56.6 ttm . . . . . 0 N--CA 1.489 1.518 0 CA-C-O 118.191 -0.909 . . . . 0.0 110.343 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -60.0 166.74 8.27 Favored 'Trans proline' 0 CA--C 1.544 1.006 0 C-N-CA 123.98 3.12 . . . . 0.0 113.199 172.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -56.8 148.75 64.33 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 123.463 2.775 . . . . 0.0 113.313 174.593 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.2 t -171.76 147.72 2.29 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.496 1.518 . . . . 0.0 111.395 -178.563 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -122.52 135.36 54.63 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.166 1.386 . . . . 0.0 110.776 -172.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 94.2 p -141.01 157.14 67.84 Favored Pre-proline 0 CA--C 1.55 0.98 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -179.007 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -69.84 162.58 84.05 Favored 'Cis proline' 0 C--N 1.353 0.809 0 CA-C-N 118.919 0.65 . . . . 0.0 111.279 -9.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.33 -34.1 71.94 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 171.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 53.2 tp -140.16 122.91 16.4 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.433 1.493 . . . . 0.0 109.41 172.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.9 tp -105.16 127.23 52.81 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.76 1.624 . . . . 0.0 109.186 171.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.8 t -111.05 124.5 67.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 123.912 0.885 . . . . 0.0 108.879 172.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.1 m -129.38 168.14 23.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 C-N-CA 124.935 1.294 . . . . 0.0 111.567 172.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 23.4 m -92.33 151.67 20.17 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.165 1.386 . . . . 0.0 110.44 173.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -52.13 123.89 11.68 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.436 1.094 . . . . 0.0 110.7 169.026 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 89.5 -2.92 83.43 Favored Glycine 0 CA--C 1.533 1.16 0 C-N-CA 125.616 1.579 . . . . 0.0 114.762 -177.614 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -91.31 158.39 16.58 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 119.393 1.597 . . . . 0.0 112.012 175.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -87.65 123.59 32.65 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.171 0.988 . . . . 0.0 110.901 178.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -101.59 129.96 47.81 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.955 1.302 . . . . 0.0 110.534 177.072 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 27.1 m -131.7 128.02 38.09 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.407 1.083 . . . . 0.0 111.021 177.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -102.8 154.5 19.12 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 126.628 1.971 . . . . 0.0 110.505 169.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 65.4 m -107.37 134.15 50.85 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.172 1.389 . . . . 0.0 109.001 170.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 73.2 m -130.05 114.73 16.14 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.653 1.181 . . . . 0.0 110.337 175.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 22.6 t -97.4 154.65 17.33 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 125.142 1.377 . . . . 0.0 110.237 179.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 53.8 m-85 -147.44 156.31 42.75 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.742 1.217 . . . . 0.0 113.979 -169.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 24.0 t -130.09 129.6 43.78 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.795 1.238 . . . . 0.0 108.726 168.429 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 63.0 m-80 -143.33 121.74 12.38 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.543 1.137 . . . . 0.0 111.209 -178.155 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 23.4 m -76.23 -30.48 57.95 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.89 1.276 . . . . 0.0 110.575 169.28 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.7 m -53.32 134.07 39.81 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 127.608 2.363 . . . . 0.0 113.126 177.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -63.02 -26.15 68.71 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.672 1.589 . . . . 0.0 112.921 -179.076 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.4 t -160.8 161.02 31.9 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.043 1.737 . . . . 0.0 110.475 171.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 38.5 p90 -163.69 158.14 20.04 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.335 1.454 . . . . 0.0 112.031 -169.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.7 t -95.95 133.08 38.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 125.513 1.525 . . . . 0.0 108.178 169.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.32 129.46 45.53 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.445 1.098 . . . . 0.0 108.694 169.264 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 35.2 m120 -125.52 147.75 49.14 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.108 1.363 . . . . 0.0 111.133 179.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 18.9 t90 -122.02 139.39 53.75 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.482 1.113 . . . . 0.0 111.473 176.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -135.44 144.84 46.68 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.496 1.118 . . . . 0.0 113.859 -170.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.4 ttt-85 -106.54 134.97 48.86 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.516 1.126 . . . . 0.0 108.85 167.556 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.95 130.36 34.49 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.679 1.592 . . . . 0.0 110.614 170.643 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 19.0 m -104.31 158.79 31.2 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 126.014 1.725 . . . . 0.0 111.727 179.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -67.71 -17.42 47.65 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 123.986 3.124 . . . . 0.0 113.98 -174.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 70.6 m -80.08 21.94 0.55 Allowed 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 124.33 1.052 . . . . 0.0 112.28 168.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . 0.274 0.9 OUTLIER 54.31 33.85 19.28 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 128.147 2.579 . . . . 0.0 114.561 179.265 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -118.01 158.9 24.12 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.793 1.237 . . . . 0.0 111.397 178.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.3 p -113.0 144.35 42.74 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 125.815 1.646 . . . . 0.0 109.79 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -129.04 130.69 46.91 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 123.636 0.774 . . . . 0.0 111.313 177.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 32.0 ttmt -74.24 121.15 20.82 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.688 1.195 . . . . 0.0 110.355 -178.065 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 80.2 mt -94.48 -47.57 6.5 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 125.51 1.524 . . . . 0.0 111.911 -170.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -167.84 170.5 10.67 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 127.287 2.235 . . . . 0.0 109.18 -177.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.65 161.78 35.04 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.181 0.992 . . . . 0.0 112.451 -171.124 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -144.18 118.5 5.92 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.872 1.269 . . . . 0.0 111.131 169.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -53.54 155.74 14.7 Favored 'Cis proline' 0 C--N 1.352 0.715 0 CA-C-N 120.027 1.045 . . . . 0.0 112.166 -11.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -72.09 94.53 1.53 Allowed 'General case' 0 CA--C 1.544 0.727 0 CA-C-O 123.223 1.487 . . . . 0.0 111.966 -171.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -78.45 4.91 11.9 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 127.027 2.131 . . . . 0.0 113.967 -173.311 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 5.0 ppt_? -68.36 -31.58 71.05 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.345 1.458 . . . . 0.0 113.055 174.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.5 m 65.33 -26.21 0.1 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 128.3 2.64 . . . . 0.0 117.435 169.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 56.7 mm-40 -135.71 165.77 33.55 Favored Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 126.683 1.993 . . . . 0.0 110.816 -170.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.16 161.57 45.51 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 123.039 2.493 . . . . 0.0 111.472 171.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 107.41 -0.21 34.92 Favored Glycine 0 CA--C 1.535 1.281 0 C-N-CA 124.932 1.254 . . . . 0.0 113.635 -172.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 50.6 tp60 -63.9 129.11 38.73 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.261 1.424 . . . . 0.0 110.368 169.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -75.82 137.21 40.35 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.605 0.762 . . . . 0.0 110.902 174.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 55.9 p -76.73 -14.49 59.94 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 114.803 1.409 . . . . 0.0 114.803 -173.433 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 12.2 ptp180 -71.57 -29.8 65.14 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 119.486 1.039 . . . . 0.0 113.179 -175.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -93.77 137.42 33.03 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.49 1.116 . . . . 0.0 112.171 -173.173 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 72.1 mtm180 -140.72 151.51 44.56 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.804 1.241 . . . . 0.0 112.607 -179.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 59.0 t -126.51 126.65 69.37 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 126.078 1.751 . . . . 0.0 109.002 169.035 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 99.5 m -118.53 132.55 56.21 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.736 1.614 . . . . 0.0 109.78 176.588 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.17 141.74 28.32 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.617 1.167 . . . . 0.0 111.949 176.572 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 32.1 mt -97.77 157.98 33.74 Favored Pre-proline 0 CA--C 1.544 0.723 0 C-N-CA 123.749 0.82 . . . . 0.0 111.149 175.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -65.66 -5.02 10.81 Favored 'Trans proline' 0 CA--C 1.541 0.858 0 C-N-CA 123.411 2.741 . . . . 0.0 114.369 177.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -66.53 -25.99 66.93 Favored 'General case' 0 CA--C 1.55 0.947 0 CA-C-N 119.793 1.178 . . . . 0.0 112.428 169.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 86.68 -27.27 5.94 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 125.619 1.58 . . . . 0.0 114.04 178.342 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -130.91 73.34 1.54 Allowed 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 122.849 1.309 . . . . 0.0 108.664 171.509 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 13.2 t0 178.99 136.57 0.09 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.907 2.083 . . . . 0.0 108.596 -173.676 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -148.59 152.23 36.4 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.86 0.864 . . . . 0.0 112.773 -168.062 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 -113.62 127.06 55.92 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.169 1.388 . . . . 0.0 109.63 168.387 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 2.4 mpt? -119.1 136.51 54.12 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.622 1.169 . . . . 0.0 109.684 -179.191 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 50.4 p -141.98 147.3 36.74 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 116.122 1.897 . . . . 0.0 116.122 -169.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 21.9 t -103.52 109.09 26.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 126.642 1.977 . . . . 0.0 107.302 170.021 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 91.9 t -76.11 127.55 37.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 124.493 1.117 . . . . 0.0 109.423 175.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 53.6 ttt85 53.88 59.5 4.24 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.147 1.379 . . . . 0.0 110.955 176.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.47 150.7 47.91 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.836 0.854 . . . . 0.0 112.434 -171.537 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.95 162.63 31.53 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.934 1.693 . . . . 0.0 110.686 -179.406 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 76.9 mtm180 -55.88 -22.37 25.11 Favored 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 114.474 1.287 . . . . 0.0 114.474 -177.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -55.28 -37.96 67.98 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.846 1.258 . . . . 0.0 112.835 168.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -80.97 -26.16 36.8 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.215 1.006 . . . . 0.0 113.096 -169.118 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 46.4 m -49.74 138.41 14.56 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.935 1.294 . . . . 0.0 112.963 178.177 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 155.7 -164.26 32.08 Favored Glycine 0 N--CA 1.472 1.037 0 C-N-CA 123.88 0.753 . . . . 0.0 113.198 -176.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 21.9 m -89.95 144.61 25.77 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.276 1.031 . . . . 0.0 109.293 175.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 34.2 m-85 -135.65 158.36 44.57 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.6 1.56 . . . . 0.0 112.174 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -160.87 151.9 18.74 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 124.953 1.301 . . . . 0.0 112.3 175.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 85.3 m -103.39 170.76 7.76 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.787 1.235 . . . . 0.0 110.969 173.073 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -164.82 140.24 6.3 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 121.258 -0.901 . . . . 0.0 114.078 172.215 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -104.34 142.98 33.61 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.562 1.145 . . . . 0.0 111.124 173.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.0 tt -145.47 134.42 17.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 124.209 1.003 . . . . 0.0 111.057 176.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 2.2 m -64.24 160.88 17.66 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.735 1.214 . . . . 0.0 112.828 -179.508 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 37.2 mt -72.46 -17.57 61.76 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 -178.19 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -69.1 148.92 97.77 Favored Pre-proline 0 CA--C 1.551 0.998 0 C-N-CA 124.522 1.129 . . . . 0.0 112.48 178.137 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -69.55 -20.29 36.0 Favored 'Trans proline' 0 CA--C 1.539 0.764 0 C-N-CA 123.144 2.563 . . . . 0.0 113.214 179.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -83.04 0.44 44.85 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 124.803 1.241 . . . . 0.0 113.97 178.126 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.9 167.98 14.56 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.126 1.371 . . . . 0.0 113.928 -175.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -145.77 152.01 38.87 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.81 1.644 . . . . 0.0 109.546 177.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 51.2 mt -75.57 126.95 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 124.187 0.995 . . . . 0.0 111.215 -174.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -78.4 88.49 4.4 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.767 1.227 . . . . 0.0 109.967 169.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -83.79 158.78 21.59 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.914 1.285 . . . . 0.0 111.154 175.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 6.7 t -148.61 -170.0 3.5 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.201 1.0 . . . . 0.0 112.152 173.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 98.8 mt -60.5 128.82 38.55 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.193 1.797 . . . . 0.0 111.754 -174.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.43 154.45 41.34 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.758 1.223 . . . . 0.0 112.73 -171.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.84 167.16 11.19 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 127.069 2.148 . . . . 0.0 110.234 174.239 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -135.06 143.41 46.68 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.026 -1.046 . . . . 0.0 111.781 179.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 60.6 tp -112.17 134.14 53.89 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 125.922 1.689 . . . . 0.0 110.3 172.49 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 70.8 ttt180 -124.87 117.96 25.26 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.501 1.52 . . . . 0.0 109.615 169.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 29.5 t -100.53 117.7 46.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 124.37 1.068 . . . . 0.0 108.685 169.605 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 66.8 p -97.44 154.65 17.34 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.698 1.599 . . . . 0.0 111.056 179.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -62.02 141.98 57.76 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.527 0.731 . . . . 0.0 112.629 -176.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 51.8 ttt85 -75.84 116.88 17.0 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.914 0.885 . . . . 0.0 110.164 -178.005 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 44.9 ptt85 -70.61 150.25 46.23 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.761 0.824 . . . . 0.0 113.056 -175.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -89.51 124.85 34.89 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.322 1.049 . . . . 0.0 109.055 168.572 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 . . . . . 0 N--CA 1.487 1.392 0 C-N-CA 128.342 2.657 . . . . 0.0 112.388 -170.98 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 2.1 tmt? . . . . . 0 N--CA 1.488 1.473 0 CA-C-O 118.687 -0.673 . . . . 0.0 110.188 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_endo -83.24 152.12 13.9 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.569 2.846 . . . . 0.0 111.124 177.269 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -65.13 130.78 26.56 Favored 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 122.687 2.258 . . . . 0.0 110.007 172.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 37.8 m -139.8 148.16 41.79 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.926 0.891 . . . . 0.0 111.378 -169.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -116.8 129.23 55.97 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.6 1.96 . . . . 0.0 109.576 170.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 67.8 m -140.79 158.94 64.24 Favored Pre-proline 0 N--CA 1.479 0.98 0 C-N-CA 124.543 1.137 . . . . 0.0 113.14 -170.062 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -67.75 157.5 85.46 Favored 'Cis proline' 0 C--N 1.354 0.833 0 CA-C-N 119.938 1.014 . . . . 0.0 111.398 -5.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -55.03 -25.92 33.67 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.109 0.963 . . . . 0.0 113.5 176.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 43.3 tp -143.5 116.18 8.69 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.582 1.553 . . . . 0.0 108.441 168.698 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 38.0 tp -97.32 127.47 43.31 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.416 1.086 . . . . 0.0 109.018 169.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.8 t -114.04 123.14 69.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 124.067 0.947 . . . . 0.0 108.662 173.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 32.6 m -127.03 162.52 31.72 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 124.529 1.132 . . . . 0.0 112.134 174.013 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 11.6 m -87.52 148.65 24.82 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.378 1.071 . . . . 0.0 110.502 173.076 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -59.2 125.7 24.69 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.019 0.928 . . . . 0.0 111.753 -179.254 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.66 -3.49 85.02 Favored Glycine 0 CA--C 1.532 1.11 0 C-N-CA 125.805 1.669 . . . . 0.0 114.51 -175.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -85.35 156.03 21.07 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 119.601 1.7 . . . . 0.0 110.814 171.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -82.46 134.81 35.22 Favored 'General case' 0 CA--C 1.543 0.68 0 O-C-N 121.405 -0.809 . . . . 0.0 111.24 171.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -104.47 123.64 47.84 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.713 1.605 . . . . 0.0 110.052 177.342 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 94.7 m -122.9 125.22 44.93 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.41 0.684 . . . . 0.0 110.985 176.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -102.82 159.6 15.34 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 127.264 2.225 . . . . 0.0 110.522 174.363 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 80.6 m -105.71 130.08 53.79 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.854 1.261 . . . . 0.0 109.997 170.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 54.0 t -110.29 140.5 44.39 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.382 1.473 . . . . 0.0 109.814 168.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 6.1 t -144.38 132.24 21.38 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.355 -0.84 . . . . 0.0 110.534 -178.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -127.32 139.29 52.98 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 125.645 1.578 . . . . 0.0 113.636 -177.217 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 29.3 t -93.58 117.9 30.68 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 165.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 41.2 t-20 -157.13 131.68 8.63 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.684 -0.635 . . . . 0.0 111.762 -169.26 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 29.1 p -91.47 -13.56 32.03 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 126.182 1.793 . . . . 0.0 113.84 -178.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 70.3 m -68.58 129.95 41.43 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.353 1.061 . . . . 0.0 111.507 178.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -63.71 -26.95 68.89 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.05 1.34 . . . . 0.0 112.788 -179.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 21.2 t -151.18 146.19 25.93 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.999 1.319 . . . . 0.0 110.777 171.139 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 52.4 p90 -163.91 159.06 20.52 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.17 1.788 . . . . 0.0 110.611 -175.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 50.4 t -95.92 125.22 48.78 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.43 1.092 . . . . 0.0 108.268 174.098 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 58.6 tp -101.57 128.9 47.62 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.388 0.675 . . . . 0.0 109.557 169.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 28.8 m-80 -116.64 163.17 16.51 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.637 1.575 . . . . 0.0 111.154 -175.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 19.8 t90 -133.19 138.88 46.73 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.756 1.222 . . . . 0.0 111.832 -178.376 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -137.43 146.56 44.51 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.291 1.436 . . . . 0.0 113.717 -172.073 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 27.7 ttp-105 -104.12 142.62 34.17 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.949 1.7 . . . . 0.0 107.727 167.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 35.4 mtp -88.27 131.47 34.77 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 119.077 0.853 . . . . 0.0 111.027 170.075 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 37.9 m -92.65 155.56 41.84 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 124.807 1.243 . . . . 0.0 111.43 175.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -66.67 -19.32 53.88 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 123.566 2.844 . . . . 0.0 113.775 -175.22 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.7 m -76.94 8.54 3.69 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 124.753 1.221 . . . . 0.0 113.277 171.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 26.4 m120 73.29 21.01 3.13 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 127.851 2.46 . . . . 0.0 113.37 179.231 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 21.9 mm100 -96.7 175.37 6.4 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.669 1.187 . . . . 0.0 111.265 174.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.2 p -126.53 139.84 52.9 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.976 1.71 . . . . 0.0 109.795 175.251 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 41.3 t0 -120.57 130.68 54.31 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 125.323 1.449 . . . . 0.0 110.667 -177.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 41.7 tttm -82.79 123.12 29.04 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.454 1.102 . . . . 0.0 111.415 -171.435 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.5 mt -100.37 -45.65 5.51 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.77 1.228 . . . . 0.0 112.912 -169.069 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -174.05 176.71 2.5 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.337 1.855 . . . . 0.0 110.353 -178.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -157.75 166.29 33.15 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.959 1.303 . . . . 0.0 112.136 -179.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 21.2 t80 -142.17 122.24 8.18 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 125.087 1.355 . . . . 0.0 110.503 172.586 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -60.63 154.42 52.72 Favored 'Cis proline' 0 C--N 1.352 0.715 0 CA-C-N 119.534 0.869 . . . . 0.0 110.92 -9.363 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -62.68 97.76 0.11 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.611 1.165 . . . . 0.0 114.005 -169.23 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -77.99 44.19 0.47 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 127.085 2.154 . . . . 0.0 111.125 169.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 16.2 ttt180 -70.79 -1.57 11.99 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 115.019 1.489 . . . . 0.0 115.019 -169.192 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 18.9 m -67.51 -22.5 65.44 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.759 1.224 . . . . 0.0 113.39 174.09 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 64.0 mm-40 -83.35 145.85 49.42 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 123.712 0.805 . . . . 0.0 111.106 175.601 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -76.58 158.24 36.01 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.507 2.805 . . . . 0.0 112.877 -173.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 98.26 -7.18 61.94 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 125.638 1.59 . . . . 0.0 112.911 177.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -92.35 61.13 3.78 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.269 1.028 . . . . 0.0 112.17 -169.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -74.14 160.46 31.18 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 124.695 1.198 . . . . 0.0 113.588 178.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 20.7 m -70.02 -3.66 17.34 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 116.389 1.996 . . . . 0.0 116.389 -168.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 50.6 mtp180 -70.45 -29.66 66.3 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 119.465 1.03 . . . . 0.0 112.049 170.329 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 88.6 m-85 -103.23 128.3 50.27 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.554 1.542 . . . . 0.0 110.903 -175.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -142.02 148.04 37.86 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.766 1.227 . . . . 0.0 111.406 -170.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 40.9 t -126.62 136.9 59.47 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 124.976 1.311 . . . . 0.0 110.784 178.497 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 98.0 m -127.81 132.74 49.43 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.494 1.518 . . . . 0.0 110.212 175.312 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -85.12 136.48 33.53 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.08 0.952 . . . . 0.0 110.46 172.11 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 29.5 mt -89.59 159.25 44.22 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 124.135 0.974 . . . . 0.0 111.461 176.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -63.65 -6.03 9.83 Favored 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 123.489 2.793 . . . . 0.0 114.216 175.097 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -66.55 -18.99 65.67 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-N 119.224 0.92 . . . . 0.0 112.953 169.391 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 82.72 -34.18 2.76 Favored Glycine 0 N--CA 1.474 1.2 0 C-N-CA 127.386 2.422 . . . . 0.0 114.326 174.222 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 38.1 mtm105 -128.25 73.56 1.49 Allowed 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.097 1.359 . . . . 0.0 108.574 168.534 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -174.22 137.68 0.54 Allowed 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 127.743 2.417 . . . . 0.0 108.03 177.514 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -146.03 148.5 32.77 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 123.461 0.705 . . . . 0.0 112.209 -168.037 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 42.6 m170 -105.43 130.2 53.57 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.71 1.204 . . . . 0.0 111.203 169.325 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -112.0 119.31 38.04 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 126.311 1.844 . . . . 0.0 108.565 178.088 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 60.8 m -121.44 125.66 47.42 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 -169.479 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 25.8 t -96.35 111.11 25.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 125.773 1.629 . . . . 0.0 106.693 168.185 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 62.6 t -81.48 127.92 39.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 123.543 0.737 . . . . 0.0 109.766 177.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 68.0 ttt-85 57.15 67.61 0.96 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.821 1.649 . . . . 0.0 111.273 176.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -72.53 144.42 47.97 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.851 0.86 . . . . 0.0 112.289 -174.137 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 49.0 mmm-85 -123.15 162.23 22.91 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 126.625 1.97 . . . . 0.0 110.352 -177.092 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 77.2 mtm180 -55.66 -23.11 26.33 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 113.66 0.985 . . . . 0.0 113.66 174.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -54.06 -35.67 62.28 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.766 1.626 . . . . 0.0 113.586 168.271 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -87.69 -15.09 38.12 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.304 1.042 . . . . 0.0 113.72 -168.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 50.2 m -58.04 134.66 56.61 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 119.696 1.135 . . . . 0.0 112.273 177.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 146.94 -163.97 28.59 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 124.496 1.046 . . . . 0.0 113.316 -171.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.8 m -95.08 144.85 25.4 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.586 1.154 . . . . 0.0 111.783 -173.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -140.5 156.92 46.18 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.394 1.877 . . . . 0.0 112.254 -179.097 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -164.07 159.16 20.19 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.797 1.639 . . . . 0.0 112.372 179.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 7.3 p -112.49 162.99 15.0 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.543 1.137 . . . . 0.0 112.115 176.037 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -153.35 126.23 1.92 Allowed Glycine 0 N--CA 1.471 1.026 0 O-C-N 121.304 -0.872 . . . . 0.0 114.287 -176.569 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -97.23 148.78 22.75 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.484 1.114 . . . . 0.0 112.715 -177.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 17.8 tt -150.27 138.8 14.78 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 125.402 1.481 . . . . 0.0 110.532 175.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 47.4 t -65.2 158.15 26.91 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.451 -0.781 . . . . 0.0 112.72 176.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -71.76 -8.04 51.79 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 172.542 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -69.77 147.59 96.3 Favored Pre-proline 0 CA--C 1.552 1.04 0 C-N-CA 124.453 1.101 . . . . 0.0 112.275 175.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -71.02 -21.24 27.9 Favored 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 123.17 2.58 . . . . 0.0 113.311 -179.113 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -87.74 3.5 47.78 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.735 1.214 . . . . 0.0 113.821 179.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.76 167.31 17.42 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.147 1.379 . . . . 0.0 114.126 -173.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -150.45 148.86 29.26 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.221 1.808 . . . . 0.0 109.169 178.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 47.8 mt -77.15 131.12 35.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 124.219 1.008 . . . . 0.0 112.031 -170.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -101.32 117.11 34.31 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.594 1.557 . . . . 0.0 108.284 168.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -94.93 148.86 21.87 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.235 1.014 . . . . 0.0 112.134 -174.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 52.9 p -83.91 169.22 15.29 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.693 1.197 . . . . 0.0 114.074 178.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 94.5 mt -69.06 129.99 41.48 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 166.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 34.3 ptt-85 -84.68 164.15 18.79 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.931 1.292 . . . . 0.0 113.749 -169.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -146.93 163.13 37.14 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.283 1.433 . . . . 0.0 113.488 -177.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -99.13 151.48 20.93 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.726 1.61 . . . . 0.0 112.798 -176.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 61.5 tp -125.58 136.49 53.35 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 126.857 2.063 . . . . 0.0 109.851 169.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -128.11 120.46 27.44 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.7 1.6 . . . . 0.0 109.93 174.031 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 42.9 t -101.95 116.93 46.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 124.512 1.125 . . . . 0.0 108.752 169.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 82.8 p -101.98 145.37 29.37 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.653 1.581 . . . . 0.0 110.716 -178.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -55.36 145.22 22.78 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -175.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 63.7 ttt-85 -94.26 141.78 28.17 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 125.209 1.404 . . . . 0.0 109.772 175.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 35.4 ttp-105 -66.18 150.71 48.35 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.905 0.882 . . . . 0.0 110.885 170.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -75.22 102.35 4.97 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.527 0.731 . . . . 0.0 109.666 170.464 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 . . . . . 0 C--O 1.255 1.355 0 C-N-CA 125.563 1.545 . . . . 0.0 112.542 -169.774 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 16.4 tpt . . . . . 0 N--CA 1.49 1.54 0 CA-C-O 116.28 -1.819 . . . . 0.0 113.05 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -61.88 158.04 40.23 Favored 'Trans proline' 0 C--N 1.358 1.072 0 C-N-CA 122.459 2.106 . . . . 0.0 113.218 178.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -59.08 155.55 38.84 Favored 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 123.804 3.003 . . . . 0.0 114.564 175.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.2 t -163.55 159.16 21.61 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.017 1.327 . . . . 0.0 112.202 174.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -144.97 117.67 8.67 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.347 1.859 . . . . 0.0 109.619 175.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 96.9 p -140.94 161.72 52.29 Favored Pre-proline 0 CA--C 1.55 0.969 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 -169.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -71.71 164.26 84.65 Favored 'Cis proline' 0 C--N 1.354 0.826 0 CA-C-N 119.45 0.839 . . . . 0.0 111.762 -7.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.66 -26.06 68.49 Favored 'General case' 0 CA--C 1.544 0.75 0 N-CA-C 113.048 0.759 . . . . 0.0 113.048 173.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 50.7 tp -144.3 125.68 14.8 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.192 1.797 . . . . 0.0 109.326 172.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 64.7 tp -115.29 125.61 53.48 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.987 1.715 . . . . 0.0 109.266 174.304 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.9 t -110.25 122.98 65.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 124.144 0.978 . . . . 0.0 109.16 175.038 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 32.0 m -129.2 176.22 8.75 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 125.753 1.621 . . . . 0.0 111.861 176.456 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 26.1 m -103.95 151.68 22.88 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 126.08 1.752 . . . . 0.0 110.402 176.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -53.51 121.98 8.82 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.294 1.038 . . . . 0.0 111.777 171.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.0 2.36 69.1 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 125.442 1.496 . . . . 0.0 114.407 -177.089 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -93.85 149.37 21.29 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.665 1.732 . . . . 0.0 112.544 177.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 21.6 m120 -72.93 113.22 9.72 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.255 1.022 . . . . 0.0 110.757 172.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -97.5 124.99 41.92 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.79 0.836 . . . . 0.0 110.514 177.63 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 32.1 m -129.53 123.27 31.02 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 118.633 0.651 . . . . 0.0 111.53 -173.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -101.55 149.81 23.72 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.609 1.564 . . . . 0.0 110.371 169.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 62.1 m -102.67 126.34 49.73 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.985 1.314 . . . . 0.0 109.475 177.454 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 37.5 t -124.33 142.05 51.58 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.147 1.379 . . . . 0.0 112.314 175.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 80.7 p -150.59 148.79 29.07 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.146 -0.971 . . . . 0.0 112.133 170.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -139.2 156.12 47.33 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.822 2.049 . . . . 0.0 111.962 178.486 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 70.9 m -132.64 142.84 49.29 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.245 1.418 . . . . 0.0 109.247 168.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 53.7 m-80 -137.66 156.26 48.23 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.811 1.245 . . . . 0.0 111.827 -176.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 19.6 p -74.03 -34.0 63.95 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.465 1.506 . . . . 0.0 112.189 174.149 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 13.1 m -65.02 152.14 44.18 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.841 1.656 . . . . 0.0 112.269 172.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -68.61 -14.73 63.2 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 114.741 1.386 . . . . 0.0 114.741 -175.111 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 13.3 m -166.36 159.53 14.84 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 126.529 1.932 . . . . 0.0 111.376 178.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 55.5 p90 -156.62 157.41 35.22 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.878 1.271 . . . . 0.0 112.475 -176.413 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.7 t -96.03 129.02 46.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 125.179 1.392 . . . . 0.0 107.995 170.058 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 34.1 tp -99.37 140.29 33.77 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.222 1.009 . . . . 0.0 109.968 171.294 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -135.49 146.37 48.08 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.337 1.455 . . . . 0.0 111.02 -170.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 17.3 t90 -118.37 139.9 50.67 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.031 1.332 . . . . 0.0 111.297 177.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -136.99 147.7 46.44 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.725 1.21 . . . . 0.0 113.783 -172.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 74.4 ttt180 -105.68 140.06 39.31 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.41 1.484 . . . . 0.0 108.315 167.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 29.8 mtp -81.82 145.92 30.16 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.011 0.823 . . . . 0.0 112.414 177.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 67.7 m -104.68 148.91 36.83 Favored Pre-proline 0 CA--C 1.544 0.745 0 C-N-CA 125.657 1.583 . . . . 0.0 110.793 173.408 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -67.16 -17.9 50.73 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 123.682 2.921 . . . . 0.0 113.278 -177.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 12.0 m -76.87 19.25 0.3 Allowed 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 125.759 1.624 . . . . 0.0 113.29 171.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 44.8 m-80 68.63 33.84 3.72 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 127.425 2.29 . . . . 0.0 112.587 177.01 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -130.06 -172.68 2.84 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.453 1.501 . . . . 0.0 110.798 -172.121 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.1 p -148.01 145.12 28.38 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.909 1.684 . . . . 0.0 110.215 -171.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -120.12 131.61 55.11 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 124.638 1.175 . . . . 0.0 111.002 175.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -76.17 129.51 36.85 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.561 0.744 . . . . 0.0 111.307 -179.359 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 55.7 mt -101.98 -51.25 3.45 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 125.473 1.509 . . . . 0.0 111.406 -173.165 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -163.4 173.55 13.05 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.822 1.649 . . . . 0.0 110.387 -175.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.6 168.39 26.21 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.508 1.123 . . . . 0.0 112.759 -174.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 52.3 t80 -142.73 122.8 7.98 Favored Pre-proline 0 CA--C 1.546 0.8 0 C-N-CA 124.992 1.317 . . . . 0.0 110.332 169.439 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -62.92 159.33 61.83 Favored 'Cis proline' 0 C--N 1.351 0.705 0 CA-C-N 119.683 0.922 . . . . 0.0 111.399 -8.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -76.59 94.64 3.78 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 121.932 0.873 . . . . 0.0 110.997 -177.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -82.4 0.88 40.0 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.889 1.676 . . . . 0.0 114.225 -177.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 52.3 ptt85 -63.91 -23.63 67.42 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.717 1.607 . . . . 0.0 114.253 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 25.3 p 69.71 -35.28 0.31 Allowed 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 129.333 3.053 . . . . 0.0 115.464 177.587 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -135.74 161.92 60.0 Favored Pre-proline 0 CA--C 1.546 0.811 0 C-N-CA 126.104 1.762 . . . . 0.0 111.485 -169.306 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -79.8 -177.44 3.84 Favored 'Trans proline' 0 CA--C 1.542 0.91 0 C-N-CA 124.313 3.342 . . . . 0.0 111.557 172.233 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 121.9 -5.06 10.58 Favored Glycine 0 CA--C 1.534 1.239 0 C-N-CA 124.995 1.283 . . . . 0.0 114.772 176.199 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -80.22 164.84 22.94 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.147 0.979 . . . . 0.0 111.916 171.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -73.41 157.74 36.31 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.359 1.064 . . . . 0.0 112.92 172.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 17.7 m -80.33 -7.88 59.25 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 115.517 1.673 . . . . 0.0 115.517 -169.693 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -69.54 -47.48 63.56 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 119.706 1.139 . . . . 0.0 113.693 -169.414 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -90.15 124.94 35.25 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.04 0.936 . . . . 0.0 112.944 -168.111 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 23.4 mmt85 -129.82 156.63 44.03 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.84 1.656 . . . . 0.0 111.831 178.137 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 87.7 t -126.6 130.53 71.69 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 C-N-CA 125.65 1.58 . . . . 0.0 109.771 169.774 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 97.8 m -126.0 132.0 52.11 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 125.08 1.352 . . . . 0.0 110.16 177.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 63.0 tt0 -84.64 138.02 32.93 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.597 1.159 . . . . 0.0 111.043 177.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 28.6 mt -91.55 162.37 31.78 Favored Pre-proline 0 CA--C 1.548 0.877 0 C-N-CA 124.102 0.961 . . . . 0.0 112.063 176.31 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -56.03 -20.88 32.02 Favored 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 124.213 3.276 . . . . 0.0 114.211 172.605 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 21.7 m120 -60.74 -18.44 54.6 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 176.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 90.48 -34.06 4.32 Favored Glycine 0 N--CA 1.474 1.196 0 C-N-CA 126.569 2.033 . . . . 0.0 114.549 169.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 26.0 ptt-85 -138.8 73.58 1.44 Allowed 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 123.883 1.802 . . . . 0.0 109.72 168.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -164.53 137.33 4.84 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 127.872 2.469 . . . . 0.0 106.52 -179.058 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -144.75 143.47 30.69 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -166.628 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -96.69 116.03 28.43 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.973 1.309 . . . . 0.0 110.322 168.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -94.55 108.05 20.01 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 126.558 1.943 . . . . 0.0 107.621 174.336 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 19.4 m -116.51 126.99 54.14 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.847 1.055 . . . . 0.0 113.847 -167.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 21.3 t -94.66 104.83 16.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 N-CA-C 106.722 -1.584 . . . . 0.0 106.722 168.051 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 81.0 t -70.4 121.08 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 124.647 1.179 . . . . 0.0 109.731 179.442 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 51.87 57.27 6.7 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.793 1.637 . . . . 0.0 112.039 176.32 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -59.57 140.04 56.66 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.254 1.422 . . . . 0.0 112.056 -173.086 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 19.8 mmm-85 -115.05 168.31 10.04 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.641 1.576 . . . . 0.0 110.508 177.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 59.0 mtp85 -51.2 -35.29 35.78 Favored 'General case' 0 N--CA 1.479 0.997 0 O-C-N 121.023 -1.048 . . . . 0.0 112.855 176.149 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -57.43 -22.59 44.26 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.14 1.776 . . . . 0.0 114.994 173.115 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -86.68 -10.88 52.78 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.774 1.229 . . . . 0.0 113.53 177.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 65.4 m -63.97 137.74 58.14 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 120.196 -1.565 . . . . 0.0 112.312 -179.435 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 152.23 -166.7 31.14 Favored Glycine 0 N--CA 1.47 0.901 0 C-N-CA 123.996 0.808 . . . . 0.0 113.298 -179.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.6 m -93.63 141.79 28.08 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.367 1.067 . . . . 0.0 110.467 -176.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -136.05 160.12 39.6 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.548 1.939 . . . . 0.0 110.972 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.7 pp -154.09 163.52 39.96 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 121.12 -0.988 . . . . 0.0 112.262 174.036 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 34.6 t -124.59 141.18 52.29 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.288 1.435 . . . . 0.0 110.494 -177.125 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -150.24 143.78 11.11 Favored Glycine 0 N--CA 1.47 0.96 0 N-CA-C 114.938 0.735 . . . . 0.0 114.938 -175.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -115.86 154.3 29.96 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.009 1.324 . . . . 0.0 113.04 -177.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 17.2 tt -146.64 133.29 13.85 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 125.344 1.458 . . . . 0.0 110.469 176.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 31.7 p -71.47 161.55 30.85 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.124 0.97 . . . . 0.0 113.427 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 47.3 mt -75.22 -3.42 32.98 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 114.233 1.197 . . . . 0.0 114.233 -179.047 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -67.8 151.69 96.97 Favored Pre-proline 0 CA--C 1.551 0.986 0 C-N-CA 124.729 1.212 . . . . 0.0 112.612 178.193 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -69.29 -23.9 32.43 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 122.939 2.426 . . . . 0.0 112.693 175.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 57.2 mtmt -92.39 10.28 30.61 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.247 1.419 . . . . 0.0 113.591 178.566 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -64.23 161.62 16.18 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.815 1.246 . . . . 0.0 114.014 -175.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 25.9 tt0 -147.07 149.02 32.26 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.02 1.728 . . . . 0.0 109.105 179.037 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 58.1 mt -77.21 123.93 34.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 123.181 0.592 . . . . 0.0 110.967 -176.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -93.99 137.84 32.76 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.506 1.522 . . . . 0.0 108.709 168.19 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -120.06 142.41 48.88 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.098 0.959 . . . . 0.0 111.797 -175.29 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 23.7 m -89.65 167.13 13.16 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.192 0.997 . . . . 0.0 112.251 169.56 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.4 139.38 58.21 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.12 0.968 . . . . 0.0 110.665 176.202 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.57 151.88 44.55 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -172.838 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.87 161.12 19.25 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.062 1.745 . . . . 0.0 111.347 174.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -120.95 135.46 55.2 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.036 1.334 . . . . 0.0 110.016 176.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 46.3 tp -107.79 128.82 54.93 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 125.622 1.569 . . . . 0.0 109.724 173.498 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 4.5 tpm_? -123.83 113.14 18.14 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.122 1.769 . . . . 0.0 109.203 177.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 16.3 t -106.85 114.48 46.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 123.628 0.771 . . . . 0.0 109.799 176.652 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 70.2 p -95.25 159.27 15.09 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.43 1.892 . . . . 0.0 111.593 -176.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -67.57 141.48 56.8 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.433 0.693 . . . . 0.0 112.168 -178.184 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 68.9 ttp85 -84.1 131.37 34.8 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 124.419 1.088 . . . . 0.0 110.113 178.199 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 65.9 ttp85 -71.33 141.41 50.45 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.7 0.8 . . . . 0.0 111.495 179.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -73.8 154.32 39.58 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.551 1.14 . . . . 0.0 112.667 176.173 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 2.4 pp20? . . . . . 0 C--O 1.253 1.271 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 177.864 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 24.9 ptp . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 118.416 -0.802 . . . . 0.0 111.226 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -76.92 170.22 20.22 Favored 'Trans proline' 0 CA--C 1.545 1.07 0 C-N-CA 123.638 2.892 . . . . 0.0 111.811 174.311 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -55.18 153.58 26.22 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 124.244 3.296 . . . . 0.0 112.971 169.466 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 13.7 t -147.93 153.95 39.72 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.041 0.936 . . . . 0.0 112.023 -179.254 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -143.92 113.88 7.27 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 127.535 2.334 . . . . 0.0 107.982 178.332 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 95.1 p -140.83 159.61 61.71 Favored Pre-proline 0 CA--C 1.55 0.951 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 -168.662 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.22 161.72 84.06 Favored 'Cis proline' 0 C--N 1.355 0.916 0 CA-C-N 119.419 0.828 . . . . 0.0 111.598 -6.73 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.43 -27.86 69.29 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 175.062 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 tt -132.57 115.36 15.36 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 126.453 1.901 . . . . 0.0 108.71 173.847 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.7 tp -107.15 121.18 43.99 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.933 0.893 . . . . 0.0 109.63 172.092 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.0 t -106.38 125.54 62.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 124.132 0.973 . . . . 0.0 108.661 172.737 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.9 m -129.42 166.67 26.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 124.363 1.065 . . . . 0.0 111.422 169.804 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 73.6 m -88.76 150.33 23.0 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.26 1.024 . . . . 0.0 110.344 170.424 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -53.81 116.9 2.77 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.551 1.541 . . . . 0.0 111.313 173.335 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 89.67 8.31 67.82 Favored Glycine 0 CA--C 1.534 1.247 0 CA-C-O 118.547 -1.141 . . . . 0.0 114.62 -176.295 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -99.5 155.34 17.62 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 119.408 1.604 . . . . 0.0 111.96 171.484 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -78.5 119.56 21.96 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.99 0.916 . . . . 0.0 110.969 179.895 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -98.91 126.72 44.66 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.685 1.194 . . . . 0.0 110.749 175.941 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 97.7 m -132.78 125.6 30.49 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.774 0.83 . . . . 0.0 111.61 179.74 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -100.05 154.16 18.64 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.837 1.655 . . . . 0.0 109.441 168.191 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.3 m -106.52 134.26 49.93 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.689 1.195 . . . . 0.0 109.369 173.493 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 43.2 t -126.39 139.63 53.12 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.637 1.575 . . . . 0.0 111.959 176.156 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 99.2 p -151.23 153.38 34.79 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 121.437 -0.79 . . . . 0.0 112.132 170.594 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -130.58 156.14 45.36 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.787 1.635 . . . . 0.0 113.336 -174.778 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.8 m -113.19 116.2 29.43 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.106 1.363 . . . . 0.0 109.348 169.661 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 75.7 m-20 -139.36 140.2 37.41 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.5 1.52 . . . . 0.0 110.606 179.621 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 23.9 p -80.09 -21.53 43.22 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 125.807 1.643 . . . . 0.0 113.642 -175.755 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 32.0 p -74.94 165.22 25.6 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.121 1.369 . . . . 0.0 111.345 169.329 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -68.22 -31.72 71.43 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.279 1.432 . . . . 0.0 112.836 -173.436 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.3 t -163.12 171.03 16.97 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.903 1.281 . . . . 0.0 111.828 -176.504 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 35.6 p90 -161.09 162.46 31.59 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 126.185 1.794 . . . . 0.0 110.784 -170.02 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 79.2 t -95.87 123.14 47.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 170.091 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 22.3 tp -100.06 136.12 40.45 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.908 0.883 . . . . 0.0 109.776 176.564 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -130.71 154.69 47.68 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.689 1.596 . . . . 0.0 111.003 -169.746 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 19.3 t90 -130.9 137.68 49.43 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.755 1.222 . . . . 0.0 111.689 -177.351 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -136.15 146.43 46.89 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.53 1.132 . . . . 0.0 112.998 -173.058 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.6 ttt180 -103.71 140.88 37.0 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.962 1.305 . . . . 0.0 108.48 167.823 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 28.5 mtp -87.08 140.75 29.24 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.4 0.68 . . . . 0.0 111.931 176.719 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 48.6 m -91.94 157.62 40.98 Favored Pre-proline 0 CA--C 1.549 0.913 0 C-N-CA 124.714 1.206 . . . . 0.0 111.91 176.514 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -55.62 -34.01 88.85 Favored 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 123.957 3.104 . . . . 0.0 114.09 176.485 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.6 m -76.92 9.63 2.8 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.063 1.345 . . . . 0.0 113.855 176.935 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 26.5 m120 70.5 20.9 5.74 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 127.329 2.252 . . . . 0.0 113.386 -178.971 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -90.1 -172.67 3.57 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.555 1.142 . . . . 0.0 110.582 170.432 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.1 p -145.13 147.35 32.4 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.768 1.627 . . . . 0.0 110.488 -175.512 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -123.9 133.3 53.77 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 124.731 1.212 . . . . 0.0 111.235 174.16 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -79.92 118.8 22.0 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.916 0.886 . . . . 0.0 111.21 -178.03 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 61.8 mt -89.25 -53.75 4.42 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 125.002 1.321 . . . . 0.0 111.172 -173.709 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -165.4 172.15 12.55 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.854 1.662 . . . . 0.0 110.552 -174.797 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.59 167.81 27.6 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.27 1.428 . . . . 0.0 111.628 -178.094 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -156.22 135.08 7.67 Favored Pre-proline 0 CA--C 1.551 1.011 0 C-N-CA 123.998 0.919 . . . . 0.0 112.974 170.239 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -64.37 139.58 37.3 Favored 'Cis proline' 0 C--N 1.354 0.817 0 N-CA-C 108.98 -1.2 . . . . 0.0 108.98 -14.322 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -78.39 94.64 4.91 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 122.712 1.244 . . . . 0.0 113.218 -167.778 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -73.98 -5.47 41.5 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.177 1.391 . . . . 0.0 112.673 169.768 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 18.6 ttt180 -53.73 -52.74 59.16 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 127.444 2.298 . . . . 0.0 112.589 177.674 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.5 t 69.22 -47.69 0.59 Allowed 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 127.551 2.34 . . . . 0.0 114.558 -179.825 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -90.03 150.68 43.97 Favored Pre-proline 0 CA--C 1.548 0.883 0 C-N-CA 125.226 1.41 . . . . 0.0 112.924 -172.132 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_exo -62.03 -172.82 0.11 Allowed 'Trans proline' 0 CA--C 1.542 0.917 0 C-N-CA 124.535 3.49 . . . . 0.0 114.57 170.134 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 129.03 -12.63 6.09 Favored Glycine 0 N--CA 1.474 1.196 0 C-N-CA 125.534 1.54 . . . . 0.0 113.869 171.482 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -88.55 167.86 13.06 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.853 1.261 . . . . 0.0 111.775 169.868 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -93.99 151.37 19.59 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.621 0.769 . . . . 0.0 109.74 167.197 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 16.1 m -66.73 -7.82 23.69 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 -173.394 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 25.7 ptt-85 -84.37 -16.88 41.26 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 114.694 1.368 . . . . 0.0 114.694 179.034 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -91.02 117.74 29.82 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.47 1.108 . . . . 0.0 110.317 177.805 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -139.09 152.31 47.41 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.417 1.087 . . . . 0.0 112.343 -169.49 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 82.4 t -126.47 128.94 71.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 C-N-CA 125.841 1.656 . . . . 0.0 109.376 177.647 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 96.7 m -128.0 133.47 49.16 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.233 1.413 . . . . 0.0 110.332 -176.466 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -80.65 141.79 34.61 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.001 0.92 . . . . 0.0 112.136 176.608 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 27.2 mt -90.84 158.39 42.21 Favored Pre-proline 0 CA--C 1.545 0.764 0 C-N-CA 124.06 0.944 . . . . 0.0 111.456 172.172 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -65.23 -6.21 12.73 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.529 2.819 . . . . 0.0 114.18 174.623 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -63.0 -26.0 68.65 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 119.527 1.058 . . . . 0.0 112.66 169.436 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 98.69 -34.16 5.53 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 126.231 1.872 . . . . 0.0 114.379 172.611 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 40.6 mtm180 -136.22 73.65 1.47 Allowed 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 118.654 1.227 . . . . 0.0 109.837 170.41 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -168.81 139.83 2.49 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 128.254 2.622 . . . . 0.0 107.397 -176.861 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -143.44 149.85 38.19 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 114.457 1.28 . . . . 0.0 114.457 -167.92 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -102.08 128.67 48.45 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.622 1.569 . . . . 0.0 110.45 168.286 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -106.49 113.11 26.43 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 127.039 2.136 . . . . 0.0 108.071 176.11 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 52.9 m -121.88 132.42 54.56 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 114.817 1.414 . . . . 0.0 114.817 -167.763 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 21.9 t -102.04 104.43 16.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 167.469 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 88.1 t -69.59 126.99 30.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 123.725 0.81 . . . . 0.0 109.858 179.124 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 47.17 59.28 4.15 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.878 1.671 . . . . 0.0 112.327 177.854 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -59.92 137.7 58.01 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.049 1.34 . . . . 0.0 112.737 -170.018 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 36.5 mtp180 -100.01 158.49 15.79 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.914 1.685 . . . . 0.0 109.889 -176.91 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 20.1 mtp180 -58.92 -29.08 66.82 Favored 'General case' 0 N--CA 1.484 1.236 0 O-C-N 120.846 -1.159 . . . . 0.0 112.576 176.039 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -51.23 -30.53 17.72 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.534 1.934 . . . . 0.0 113.948 168.559 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 47.4 m-20 -90.3 -8.89 49.74 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.893 1.277 . . . . 0.0 113.119 -169.693 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 50.4 m -62.98 138.88 58.69 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.058 -1.026 . . . . 0.0 112.202 177.302 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 149.72 -170.15 29.87 Favored Glycine 0 N--CA 1.472 1.095 0 C-N-CA 124.669 1.128 . . . . 0.0 113.0 -177.029 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.6 m -89.34 140.98 28.96 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.136 0.974 . . . . 0.0 110.698 -177.517 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -132.15 160.98 34.46 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.949 2.1 . . . . 0.0 110.478 176.702 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -156.64 161.57 39.89 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.676 1.19 . . . . 0.0 112.33 175.496 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 23.6 t -113.81 151.36 32.17 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.685 1.594 . . . . 0.0 111.093 -178.006 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -152.57 136.8 5.56 Favored Glycine 0 N--CA 1.473 1.165 0 C-N-CA 124.082 0.848 . . . . 0.0 113.688 -179.529 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -111.33 153.81 25.44 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 118.352 1.076 . . . . 0.0 112.659 -179.22 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.8 tt -141.19 132.56 28.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.664 1.186 . . . . 0.0 110.44 170.414 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 29.6 t -65.22 161.57 19.04 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.805 1.242 . . . . 0.0 113.85 -175.216 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 3.1 pp -64.38 -12.65 44.83 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.445 1.498 . . . . 0.0 114.971 176.654 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -78.42 141.11 60.88 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 124.401 1.081 . . . . 0.0 112.398 -178.514 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_exo -56.59 -28.78 76.26 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.409 2.739 . . . . 0.0 114.319 173.203 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -81.92 -1.52 48.17 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.259 1.424 . . . . 0.0 113.861 -178.947 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.03 164.65 12.42 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 114.387 1.254 . . . . 0.0 114.387 -174.478 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -145.03 154.78 42.88 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.419 1.888 . . . . 0.0 108.81 176.466 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 55.8 mt -72.86 121.63 23.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 123.62 0.768 . . . . 0.0 111.328 -173.887 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -92.72 123.61 36.12 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.084 1.754 . . . . 0.0 108.944 169.071 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -87.31 145.2 26.44 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.818 0.847 . . . . 0.0 111.96 -179.005 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 5.2 t -92.77 -165.45 1.34 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.055 1.342 . . . . 0.0 112.002 170.065 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 87.3 mt -68.2 158.94 32.13 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.015 1.326 . . . . 0.0 111.206 169.895 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.29 147.46 31.42 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.76 1.224 . . . . 0.0 111.209 170.14 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -144.3 155.77 43.97 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.588 1.555 . . . . 0.0 111.342 -177.734 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -102.87 141.39 35.75 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 178.582 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 54.7 tp -99.6 131.75 45.39 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 126.836 2.054 . . . . 0.0 108.662 168.956 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 28.7 ttm180 -127.28 110.84 13.25 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.703 1.601 . . . . 0.0 109.429 -179.989 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 42.6 t -101.37 116.47 45.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 124.501 1.12 . . . . 0.0 108.84 177.519 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 72.8 p -98.1 147.79 24.2 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.628 1.571 . . . . 0.0 110.652 -178.635 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -59.53 139.81 56.82 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.267 0.627 . . . . 0.0 111.76 -177.824 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 79.1 ttt-85 -76.8 107.16 8.92 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.794 0.837 . . . . 0.0 110.311 -178.397 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -78.6 163.03 25.84 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.978 1.311 . . . . 0.0 112.861 -179.002 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -69.93 154.35 42.07 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.401 1.08 . . . . 0.0 112.541 175.151 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 . . . . . 0 C--O 1.254 1.29 0 C-N-CA 125.186 1.394 . . . . 0.0 112.923 177.337 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 57.9 ttm . . . . . 0 N--CA 1.49 1.539 0 CA-C-O 118.437 -0.792 . . . . 0.0 110.292 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -61.41 -41.53 40.41 Favored 'Trans proline' 0 CA--C 1.544 0.995 0 C-N-CA 123.37 2.714 . . . . 0.0 115.824 -177.696 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -61.32 123.8 13.51 Favored 'Trans proline' 0 C--N 1.356 0.964 0 C-N-CA 122.625 2.217 . . . . 0.0 112.369 178.219 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.7 t -167.74 156.79 9.71 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.394 1.477 . . . . 0.0 111.576 -178.541 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -161.85 111.99 1.59 Allowed 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 126.034 1.734 . . . . 0.0 109.873 177.584 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 90.0 p -141.03 161.55 53.06 Favored Pre-proline 0 CA--C 1.549 0.918 0 C-N-CA 124.618 1.167 . . . . 0.0 114.097 -174.643 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -75.71 162.83 91.61 Favored 'Cis proline' 0 C--N 1.352 0.746 0 CA-C-N 118.952 0.662 . . . . 0.0 111.456 -10.073 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.69 -25.88 67.52 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 171.868 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 40.4 tp -140.51 118.83 12.1 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 125.907 1.683 . . . . 0.0 109.012 170.688 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 50.6 tp -103.56 129.64 50.83 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.817 1.247 . . . . 0.0 109.127 169.971 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 14.0 p -112.78 128.99 69.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 123.931 0.892 . . . . 0.0 110.271 170.05 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 27.5 m -128.47 166.43 25.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 125.47 1.508 . . . . 0.0 111.865 172.911 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.6 m -90.98 148.43 22.42 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.828 1.251 . . . . 0.0 110.38 173.511 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -54.24 122.03 9.45 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.395 1.478 . . . . 0.0 111.533 176.906 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.73 -1.44 78.47 Favored Glycine 0 CA--C 1.535 1.303 0 C-N-CA 125.585 1.564 . . . . 0.0 114.897 -176.972 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -88.94 159.41 17.66 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.439 1.62 . . . . 0.0 111.381 171.748 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -87.84 135.06 33.55 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.533 -0.729 . . . . 0.0 111.474 171.476 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -108.02 129.91 55.1 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.909 1.683 . . . . 0.0 110.534 179.346 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 39.5 m -132.88 130.22 39.42 Favored 'General case' 0 N--CA 1.476 0.866 0 CA-C-N 119.256 0.935 . . . . 0.0 112.032 178.908 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -102.03 157.66 16.71 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.798 2.039 . . . . 0.0 110.894 172.259 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 46.8 m -113.02 139.75 48.41 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 125.994 1.718 . . . . 0.0 110.058 178.571 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 53.6 t -150.34 149.36 29.98 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.068 1.347 . . . . 0.0 113.08 -177.608 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 8.1 t -154.1 161.76 41.67 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.597 1.159 . . . . 0.0 112.56 169.38 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -142.1 156.31 45.38 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.946 2.098 . . . . 0.0 112.228 -178.314 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 45.6 m -83.35 108.44 16.54 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 106.165 -1.791 . . . . 0.0 106.165 166.267 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 34.2 m120 -78.9 87.11 4.75 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-O 121.689 0.757 . . . . 0.0 112.049 -168.941 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 17.6 p -77.71 -15.49 59.11 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.772 2.029 . . . . 0.0 113.426 175.714 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 63.2 m -83.5 132.53 34.94 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.804 1.242 . . . . 0.0 110.284 170.31 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.4 tm-20 -62.45 -34.53 76.98 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.644 1.177 . . . . 0.0 111.923 179.367 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 9.9 t -152.23 149.74 29.05 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 125.747 1.619 . . . . 0.0 109.12 169.286 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 54.6 p90 -159.53 163.4 35.22 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 -167.586 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.1 t -106.87 136.57 41.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 126.1 1.76 . . . . 0.0 106.917 167.689 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.6 tt -109.64 134.94 51.36 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.509 0.723 . . . . 0.0 109.777 174.845 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.442 HD21 HG22 ' A' ' 126' ' ' ILE . 2.4 m-80 -133.35 160.92 35.92 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -166.14 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 67.2 t-105 -115.54 131.65 56.87 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 126.532 1.933 . . . . 0.0 110.877 169.593 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -122.53 156.29 34.48 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.052 1.341 . . . . 0.0 111.956 179.298 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 43.6 ttt-85 -112.84 142.84 45.03 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 126.06 1.744 . . . . 0.0 109.871 169.451 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 67.2 mmm -75.78 142.52 42.3 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.84 0.856 . . . . 0.0 112.384 173.843 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.7 p -90.76 163.61 29.41 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 124.585 1.154 . . . . 0.0 111.101 168.698 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -69.66 -11.09 30.23 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 122.903 2.402 . . . . 0.0 113.086 173.204 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.0 t -94.78 8.09 43.74 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.879 1.272 . . . . 0.0 112.401 172.883 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 64.2 t30 68.84 21.89 7.46 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.744 2.018 . . . . 0.0 113.096 -178.635 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -93.19 -175.05 3.72 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.286 1.034 . . . . 0.0 109.502 169.382 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 11.9 p -138.94 150.41 45.88 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.278 1.031 . . . . 0.0 112.004 -172.859 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -133.96 133.8 41.79 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.081 0.953 . . . . 0.0 111.816 173.403 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -77.3 127.91 33.41 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.735 0.814 . . . . 0.0 111.502 -178.019 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 18.9 mt -106.56 -32.07 8.22 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.901 0.881 . . . . 0.0 113.296 178.65 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -154.57 161.45 41.61 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.303 1.441 . . . . 0.0 111.87 -177.056 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.57 166.31 31.05 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.503 1.121 . . . . 0.0 113.23 -179.133 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -144.24 114.28 5.31 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 126.544 1.937 . . . . 0.0 109.597 174.619 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo -57.52 155.08 32.33 Favored 'Cis proline' 0 CA--C 1.538 0.707 0 CA-C-N 119.546 0.874 . . . . 0.0 112.761 -11.128 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -73.62 128.88 36.72 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.465 0.65 . . . . 0.0 112.536 178.951 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 23.1 p-10 -100.83 8.77 43.01 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 126.668 1.987 . . . . 0.0 112.754 169.723 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 50.3 mtm180 -73.54 14.38 0.36 Allowed 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.112 2.165 . . . . 0.0 115.867 -169.729 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 21.8 t -65.49 -28.26 69.07 Favored 'General case' 0 CA--C 1.548 0.869 0 O-C-N 121.096 -1.002 . . . . 0.0 111.79 169.168 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 62.3 mm-40 -75.44 142.56 74.75 Favored Pre-proline 0 CA--C 1.549 0.93 0 O-C-N 121.134 -0.979 . . . . 0.0 111.039 171.84 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -56.91 158.09 18.2 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 124.471 3.448 . . . . 0.0 115.257 -179.162 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 101.78 19.25 15.82 Favored Glycine 0 CA--C 1.532 1.133 0 C-N-CA 125.164 1.364 . . . . 0.0 113.811 177.753 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.8 pm0 -93.17 160.26 14.92 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.473 1.509 . . . . 0.0 113.343 -176.066 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -142.86 108.74 5.16 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.303 1.441 . . . . 0.0 109.475 168.999 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 17.1 m -62.02 -13.54 26.93 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.378 1.471 . . . . 0.0 114.437 -174.452 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 36.3 mtp-105 -63.37 -29.29 70.62 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 125.07 1.348 . . . . 0.0 112.682 172.574 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -85.21 139.32 31.75 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.444 1.098 . . . . 0.0 109.808 171.935 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 83.2 mtm180 -144.44 149.36 35.9 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.25 1.42 . . . . 0.0 111.605 -173.568 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 77.8 t -126.54 130.93 71.76 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 125.377 1.471 . . . . 0.0 108.409 168.988 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 58.7 m -128.82 138.76 52.24 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.871 1.268 . . . . 0.0 110.59 -174.85 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 27.0 tt0 -97.86 136.62 37.9 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.689 1.195 . . . . 0.0 110.215 170.898 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -97.36 159.87 30.19 Favored Pre-proline 0 CA--C 1.546 0.812 0 C-N-CA 125.427 1.491 . . . . 0.0 111.489 -170.431 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -66.68 -11.1 30.5 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 123.593 2.862 . . . . 0.0 114.056 -178.405 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 22.2 m120 -66.29 -19.33 65.79 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 119.087 0.858 . . . . 0.0 113.052 170.548 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 91.16 -33.87 4.53 Favored Glycine 0 N--CA 1.474 1.229 0 C-N-CA 126.391 1.948 . . . . 0.0 114.377 169.934 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 95.4 mtm-85 -129.06 73.72 1.53 Allowed 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.718 1.607 . . . . 0.0 108.659 169.594 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -170.15 141.6 2.13 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 127.341 2.257 . . . . 0.0 109.278 -178.787 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -145.46 150.36 36.34 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.624 0.726 . . . . 0.0 112.613 -169.725 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -118.98 149.49 41.53 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.421 1.488 . . . . 0.0 111.373 171.321 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.5 mpt? -128.4 124.93 37.54 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.191 0.996 . . . . 0.0 109.358 171.37 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.1 t -124.6 148.29 47.96 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -168.817 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 17.0 t -125.09 105.94 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 127.128 2.171 . . . . 0.0 107.817 176.001 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 96.1 t -80.06 131.43 34.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 124.362 1.065 . . . . 0.0 111.152 -174.997 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 48.8 ttt85 53.4 61.3 3.2 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.917 1.687 . . . . 0.0 111.278 176.002 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.4 129.31 39.56 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.426 1.091 . . . . 0.0 110.844 -172.964 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 12.7 mmt-85 -100.6 167.99 9.99 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.765 1.626 . . . . 0.0 109.511 174.464 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 90.9 mtm-85 -55.56 -34.47 64.78 Favored 'General case' 0 N--CA 1.479 1.015 0 O-C-N 120.922 -1.111 . . . . 0.0 113.009 -178.877 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 34.5 t30 -62.1 -23.79 66.74 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.395 1.478 . . . . 0.0 114.514 174.87 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -80.36 -5.72 56.86 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.087 0.955 . . . . 0.0 112.82 176.258 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 24.4 m -65.49 136.43 56.42 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 120.405 -1.434 . . . . 0.0 110.99 169.943 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 160.07 -165.44 34.76 Favored Glycine 0 N--CA 1.467 0.732 0 O-C-N 121.558 -0.714 . . . . 0.0 113.241 -177.267 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.1 m -107.87 132.22 53.68 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.088 0.955 . . . . 0.0 110.338 -175.933 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -140.71 168.11 20.58 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.661 1.585 . . . . 0.0 111.759 -174.123 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -159.99 151.02 19.25 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 115.013 1.486 . . . . 0.0 115.013 -177.034 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 46.4 t -88.77 136.96 32.73 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.964 2.106 . . . . 0.0 111.275 173.814 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -159.02 135.19 4.08 Favored Glycine 0 N--CA 1.475 1.249 0 N-CA-C 115.402 0.921 . . . . 0.0 115.402 174.859 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -99.0 159.21 15.12 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.34 1.456 . . . . 0.0 112.501 176.393 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.442 HG22 HD21 ' A' ' 66' ' ' ASN . 19.0 tt -150.97 134.78 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 125.245 1.418 . . . . 0.0 110.749 178.539 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 41.7 t -64.69 159.66 21.65 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.057 0.943 . . . . 0.0 113.105 177.279 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 44.1 mt -75.51 -12.15 60.17 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.298 0.851 . . . . 0.0 113.298 172.324 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -65.14 147.01 98.84 Favored Pre-proline 0 CA--C 1.552 1.03 0 C-N-CA 124.036 0.934 . . . . 0.0 112.775 -179.432 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -56.5 -30.32 81.91 Favored 'Trans proline' 0 C--N 1.354 0.836 0 C-N-CA 123.511 2.807 . . . . 0.0 114.208 174.142 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 60.2 mtpt -88.35 5.98 39.43 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.193 1.397 . . . . 0.0 113.975 -178.197 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -61.18 153.31 26.33 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 -173.617 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -137.06 159.05 43.04 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.396 1.878 . . . . 0.0 108.744 174.365 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 45.2 mt -78.82 123.7 36.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 O-C-N 121.72 -0.613 . . . . 0.0 110.572 -175.939 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -97.03 104.06 16.04 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 126.106 1.762 . . . . 0.0 108.251 169.065 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -123.06 158.81 29.78 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.994 1.318 . . . . 0.0 113.868 -169.056 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 53.3 m -97.92 159.08 15.16 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.373 1.069 . . . . 0.0 112.14 171.748 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 10.6 mp -63.7 130.39 44.03 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.951 0.9 . . . . 0.0 110.953 -177.674 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.21 145.69 36.4 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.85 1.426 . . . . 0.0 114.85 -170.046 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -125.91 162.89 24.16 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.739 2.015 . . . . 0.0 112.067 -176.259 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -106.31 141.48 37.57 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.938 1.295 . . . . 0.0 112.375 -172.406 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 52.5 tp -115.41 131.58 56.89 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 126.332 1.853 . . . . 0.0 109.114 169.656 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 62.3 ttm-85 -124.07 123.48 40.42 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.794 1.638 . . . . 0.0 110.367 177.638 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 40.0 t -107.8 114.02 45.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 125.037 1.335 . . . . 0.0 109.272 172.676 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 73.0 p -95.11 152.2 18.55 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.509 1.524 . . . . 0.0 110.705 178.142 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -60.02 144.54 49.08 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.617 0.767 . . . . 0.0 112.679 -176.698 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 31.7 tpt85 -74.99 109.25 8.3 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 124.269 1.028 . . . . 0.0 109.239 175.624 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 84.0 mtp180 -74.34 160.45 31.04 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.684 0.794 . . . . 0.0 110.216 172.948 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -67.81 119.66 12.87 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.474 0.71 . . . . 0.0 111.497 178.767 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 . . . . . 0 C--O 1.251 1.17 0 C-N-CA 127.414 2.286 . . . . 0.0 111.178 -176.837 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.488 1.474 0 CA-C-O 115.972 -1.965 . . . . 0.0 113.459 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -55.7 141.14 84.66 Favored 'Trans proline' 0 C--N 1.359 1.111 0 CA-C-N 123.223 2.187 . . . . 0.0 112.817 -174.915 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.2 117.17 4.88 Favored 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 122.982 2.455 . . . . 0.0 111.993 -170.919 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.9 t -179.09 159.28 0.97 Allowed 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 127.216 2.206 . . . . 0.0 111.211 -178.162 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -125.03 133.64 52.87 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.803 1.641 . . . . 0.0 110.121 -178.538 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 93.6 p -140.96 155.19 68.95 Favored Pre-proline 0 CA--C 1.551 0.981 0 N-CA-C 114.511 1.3 . . . . 0.0 114.511 -176.756 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -68.96 162.03 82.66 Favored 'Cis proline' 0 C--N 1.353 0.766 0 CA-C-N 119.101 0.715 . . . . 0.0 111.511 -7.422 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.33 -32.61 70.24 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 122.803 0.441 . . . . 0.0 112.169 173.119 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 50.1 tp -140.23 120.41 13.81 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 125.452 1.501 . . . . 0.0 109.294 171.175 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 55.8 tp -100.6 125.89 47.02 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.439 1.496 . . . . 0.0 109.003 170.104 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.8 t -108.82 125.64 65.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 171.203 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 27.7 m -128.69 163.4 33.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 124.775 1.23 . . . . 0.0 110.83 173.014 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 52.7 m -88.21 146.95 25.1 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.592 0.757 . . . . 0.0 110.097 169.911 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -54.36 123.04 11.73 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.289 1.436 . . . . 0.0 111.074 174.822 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.08 3.52 72.97 Favored Glycine 0 CA--C 1.532 1.111 0 C-N-CA 125.863 1.697 . . . . 0.0 114.9 -174.733 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -90.26 157.02 17.88 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 119.612 1.706 . . . . 0.0 111.376 169.214 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -85.49 119.77 26.21 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.763 0.825 . . . . 0.0 109.957 174.628 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -98.84 129.62 45.23 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.466 1.107 . . . . 0.0 110.752 -179.246 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 89.9 m -132.73 131.46 41.24 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 119.352 0.978 . . . . 0.0 111.692 177.392 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -102.93 155.93 18.02 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.381 1.873 . . . . 0.0 111.089 172.52 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.6 m -98.68 136.03 39.32 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 125.402 1.481 . . . . 0.0 107.887 168.874 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 35.7 t -138.1 124.68 20.83 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 124.639 1.176 . . . . 0.0 110.308 -179.704 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 75.6 m -116.14 143.89 44.88 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 124.228 1.011 . . . . 0.0 111.094 -173.219 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -141.23 152.98 45.02 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 125.185 1.394 . . . . 0.0 113.694 170.026 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.1 t -132.83 143.37 49.49 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 166.435 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -146.85 145.36 29.83 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.528 0.731 . . . . 0.0 112.43 -168.208 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 24.4 p -86.84 -16.96 34.56 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.475 1.51 . . . . 0.0 113.529 -177.279 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 74.6 m -88.43 160.3 17.61 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.54 1.136 . . . . 0.0 111.629 173.5 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -69.91 -16.13 63.18 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.027 1.331 . . . . 0.0 114.107 -177.155 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.5 t -161.73 157.54 24.5 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.466 1.507 . . . . 0.0 111.027 177.597 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 53.9 p90 -155.83 153.6 30.02 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.126 1.37 . . . . 0.0 111.946 -177.299 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.6 t -95.98 128.24 47.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 171.466 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -112.77 118.67 35.61 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 125.379 1.471 . . . . 0.0 108.687 -177.123 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -116.48 155.24 28.96 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.921 1.688 . . . . 0.0 111.636 -169.438 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 13.6 t90 -124.32 138.57 54.37 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.726 1.211 . . . . 0.0 112.29 179.941 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 53.7 m-85 -136.65 145.61 45.01 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.031 1.333 . . . . 0.0 113.528 -174.973 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 78.9 ttt-85 -106.42 142.0 36.8 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.683 1.593 . . . . 0.0 108.414 167.833 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 37.1 mtp -86.73 145.37 26.69 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 119.034 0.833 . . . . 0.0 112.624 177.864 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.6 m -92.41 159.13 37.57 Favored Pre-proline 0 CA--C 1.547 0.86 0 C-N-CA 125.056 1.342 . . . . 0.0 111.999 175.755 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -57.79 -25.73 70.23 Favored 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 124.102 3.201 . . . . 0.0 114.224 174.412 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 33.5 p -77.06 -0.56 25.11 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.474 1.91 . . . . 0.0 114.017 174.943 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 71.16 20.87 4.99 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 127.178 2.191 . . . . 0.0 112.442 -173.111 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 20.5 mm100 -88.3 -172.67 3.88 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.033 0.933 . . . . 0.0 110.083 168.99 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.7 p -141.35 150.1 42.0 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.761 1.624 . . . . 0.0 110.628 -175.817 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -128.15 132.26 48.91 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.786 1.234 . . . . 0.0 111.032 176.909 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 57.0 tttt -79.76 132.47 36.17 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.372 0.669 . . . . 0.0 111.644 -176.639 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 67.9 mt -106.88 -46.09 4.03 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.077 1.351 . . . . 0.0 112.487 -169.921 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -174.15 175.95 2.61 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 127.175 2.19 . . . . 0.0 110.089 -174.478 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.63 167.7 27.83 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.888 1.275 . . . . 0.0 112.318 -179.363 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.461 ' CG ' ' HA ' ' A' ' 83' ' ' PRO . 54.7 t80 -129.33 144.0 51.06 Favored Pre-proline 0 CA--C 1.549 0.909 0 C-N-CA 126.181 1.792 . . . . 0.0 110.226 169.808 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.461 ' HA ' ' CG ' ' A' ' 82' ' ' PHE . 68.4 Cg_exo -58.03 -42.06 0.32 Allowed 'Cis proline' 0 C--N 1.356 0.969 0 N-CA-C 116.352 1.635 . . . . 0.0 116.352 2.755 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -145.43 152.94 40.61 Favored 'General case' 0 C--N 1.313 -0.998 0 C-N-CA 129.097 2.959 . . . . 0.0 113.048 177.292 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -96.11 4.81 52.24 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.488 1.515 . . . . 0.0 114.249 175.916 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 77.3 mtp85 -61.19 -11.13 8.03 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 115.66 1.726 . . . . 0.0 115.66 -169.388 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 47.2 p -71.67 -20.37 61.95 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.641 1.176 . . . . 0.0 113.918 172.297 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -135.82 168.55 16.84 Favored Pre-proline 0 CA--C 1.548 0.9 0 C-N-CA 125.761 1.625 . . . . 0.0 111.542 -176.498 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -59.55 138.48 83.96 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 123.264 2.642 . . . . 0.0 111.889 169.626 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -97.35 -27.0 9.56 Favored Glycine 0 N--CA 1.471 1.015 0 C-N-CA 124.914 1.245 . . . . 0.0 111.762 177.606 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 70.11 -40.62 0.47 Allowed 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 129.812 3.245 . . . . 0.0 116.069 167.5 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -142.95 131.13 21.93 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.427 1.891 . . . . 0.0 111.021 176.868 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 14.7 m -71.96 -3.84 24.99 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.433 1.093 . . . . 0.0 113.607 176.662 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 46.5 mtp85 -66.78 -28.09 68.11 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.649 1.579 . . . . 0.0 113.703 -175.572 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 -101.43 142.32 32.99 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.139 1.775 . . . . 0.0 112.013 -172.673 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 65.3 ttt180 -143.48 144.36 31.96 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.63 1.572 . . . . 0.0 111.27 178.475 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 57.6 t -120.34 132.56 69.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 125.663 1.585 . . . . 0.0 109.08 169.707 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 25.0 m -126.66 133.79 50.89 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.922 1.289 . . . . 0.0 109.858 177.11 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -84.86 138.38 32.58 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.398 0.679 . . . . 0.0 110.67 172.481 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 41.5 mt -85.07 159.61 56.65 Favored Pre-proline 0 CA--C 1.544 0.717 0 C-N-CA 124.863 1.265 . . . . 0.0 111.771 179.247 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -63.03 -5.91 8.61 Favored 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 123.675 2.917 . . . . 0.0 113.95 174.012 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 23.2 m120 -60.93 -25.22 66.62 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.191 0.996 . . . . 0.0 112.852 169.251 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 89.23 -16.51 55.67 Favored Glycine 0 N--CA 1.476 1.308 0 C-N-CA 125.53 1.538 . . . . 0.0 114.768 174.427 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.6 ptp180 -154.57 73.69 0.91 Allowed 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 126.198 1.799 . . . . 0.0 109.487 169.816 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -173.73 148.67 1.5 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 128.378 2.671 . . . . 0.0 108.55 -178.642 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -146.66 153.48 40.35 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.796 1.035 . . . . 0.0 113.796 -166.844 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -116.33 141.75 47.75 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.887 1.675 . . . . 0.0 110.065 168.115 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 42.5 mtt -130.73 115.29 16.45 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 124.629 1.172 . . . . 0.0 110.546 -173.924 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 43.7 m -116.02 134.03 55.39 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.36 1.245 . . . . 0.0 114.36 -167.749 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 17.1 t -104.56 113.72 42.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 126.569 1.948 . . . . 0.0 106.825 167.865 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 4.0 p -77.48 133.61 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 122.513 0.325 . . . . 0.0 110.755 -179.911 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 45.92 64.11 1.59 Allowed 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 125.491 1.516 . . . . 0.0 112.08 174.12 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.02 144.41 57.3 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.368 1.067 . . . . 0.0 112.994 -169.694 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 54.3 mtp85 -114.87 158.33 22.1 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 126.598 1.959 . . . . 0.0 110.036 -176.393 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 91.0 mtm-85 -53.6 -32.62 51.87 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 -178.833 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -70.84 -18.82 62.7 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 115.676 1.732 . . . . 0.0 115.676 176.613 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -73.2 -25.55 60.81 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 119.566 1.076 . . . . 0.0 112.045 178.769 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 14.8 m -51.35 139.44 19.32 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.979 1.312 . . . . 0.0 112.905 178.923 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 152.09 -166.6 31.04 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 124.338 0.971 . . . . 0.0 113.023 -175.777 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.5 m -92.36 143.88 25.94 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.9 1.28 . . . . 0.0 110.167 -179.617 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -138.39 156.55 47.49 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.931 1.692 . . . . 0.0 111.719 -177.606 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -163.06 157.09 20.34 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.06 1.344 . . . . 0.0 112.4 177.527 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 5.6 m -100.51 162.98 12.57 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.997 0.919 . . . . 0.0 111.85 172.724 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -145.21 130.19 3.76 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 124.392 0.996 . . . . 0.0 112.163 169.437 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -111.65 145.0 40.0 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 118.41 1.105 . . . . 0.0 112.327 178.437 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.4 tt -141.34 133.58 29.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.236 1.414 . . . . 0.0 110.125 179.405 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 53.2 p -71.48 161.62 30.74 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 -176.594 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -58.44 -15.49 11.09 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 115.372 1.619 . . . . 0.0 115.372 177.399 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -70.56 136.6 85.96 Favored Pre-proline 0 CA--C 1.552 1.027 0 C-N-CA 125.047 1.339 . . . . 0.0 112.244 -178.359 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_exo -57.07 -27.89 76.12 Favored 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 123.426 2.751 . . . . 0.0 114.066 172.631 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 14.5 tppt? -84.4 1.73 43.94 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 125.395 1.478 . . . . 0.0 113.997 -177.916 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -67.11 161.41 24.64 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -172.959 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 28.0 mp0 -128.09 159.15 35.99 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.794 2.037 . . . . 0.0 108.983 170.72 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 42.4 mt -82.83 120.44 34.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 123.509 0.723 . . . . 0.0 110.597 178.868 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 15.3 ptpt -90.99 143.76 26.38 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.421 1.089 . . . . 0.0 111.241 168.648 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -140.07 158.79 43.5 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 126.255 1.822 . . . . 0.0 110.351 -173.222 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 6.2 t -136.74 -166.67 1.94 Allowed 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.269 1.028 . . . . 0.0 112.871 -179.985 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 96.4 mt -62.7 124.77 21.86 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.268 1.827 . . . . 0.0 112.423 -170.371 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 73.6 mtm-85 -62.23 151.36 36.45 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.817 1.647 . . . . 0.0 113.507 -173.965 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.89 166.26 12.17 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.668 1.987 . . . . 0.0 110.846 173.33 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -133.85 146.24 50.42 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.422 1.089 . . . . 0.0 111.996 178.727 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 59.5 tp -113.86 137.11 52.12 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 126.182 1.793 . . . . 0.0 110.201 173.051 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 61.9 ttm-85 -127.81 120.18 27.28 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 125.522 1.529 . . . . 0.0 109.699 169.412 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 43.5 t -104.32 113.35 41.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 124.786 1.234 . . . . 0.0 108.742 173.144 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 53.8 p -95.05 140.88 29.38 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.349 1.459 . . . . 0.0 110.039 -178.697 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 4.2 pm0 -61.96 144.32 55.24 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.729 0.812 . . . . 0.0 112.855 -172.406 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 45.3 ttt85 -77.66 98.32 5.42 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.049 0.939 . . . . 0.0 110.837 -170.399 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.41 162.13 27.46 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.93 1.292 . . . . 0.0 113.117 -177.245 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -70.53 154.31 42.01 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.44 1.096 . . . . 0.0 112.419 175.22 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 . . . . . 0 C--O 1.253 1.276 0 C-N-CA 125.079 1.352 . . . . 0.0 113.274 177.682 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 47.5 ttp . . . . . 0 N--CA 1.488 1.472 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.233 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -72.02 168.53 23.73 Favored 'Trans proline' 0 CA--C 1.543 0.943 0 C-N-CA 123.339 2.693 . . . . 0.0 111.104 172.459 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -55.01 126.24 21.92 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.963 2.442 . . . . 0.0 111.745 172.11 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 86.7 m -140.91 148.63 40.75 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.252 1.021 . . . . 0.0 110.944 -169.809 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -114.11 124.32 51.8 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.97 2.108 . . . . 0.0 108.11 169.318 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 88.0 p -140.75 156.09 69.05 Favored Pre-proline 0 CA--C 1.549 0.916 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -169.156 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -66.68 161.18 75.84 Favored 'Cis proline' 0 C--N 1.355 0.894 0 CA-C-N 119.84 0.979 . . . . 0.0 112.111 -2.457 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.81 -27.5 66.65 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 177.75 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 49.1 tp -141.15 122.54 14.93 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.365 1.466 . . . . 0.0 108.749 169.835 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 59.5 tp -106.16 126.06 51.75 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.157 1.383 . . . . 0.0 109.057 170.869 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.3 t -109.68 124.43 66.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 123.864 0.866 . . . . 0.0 108.798 172.998 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 33.7 m -128.66 172.43 15.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 C-N-CA 124.919 1.287 . . . . 0.0 110.951 171.43 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 66.2 m -104.48 151.92 22.98 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.516 1.526 . . . . 0.0 110.313 170.971 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -44.29 124.63 4.12 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.313 1.445 . . . . 0.0 112.967 172.357 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 89.99 -2.37 81.68 Favored Glycine 0 CA--C 1.531 1.048 0 C-N-CA 125.732 1.634 . . . . 0.0 114.484 -179.261 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -89.31 153.82 20.58 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.699 1.75 . . . . 0.0 111.909 174.367 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -80.81 118.25 22.17 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.588 0.755 . . . . 0.0 110.355 174.806 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -97.32 114.26 26.02 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.074 0.95 . . . . 0.0 110.533 178.978 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 46.9 m -122.35 124.19 43.13 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.936 0.895 . . . . 0.0 111.4 -175.288 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -102.45 158.16 16.41 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 126.646 1.978 . . . . 0.0 110.742 171.683 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 86.1 m -101.63 135.05 43.8 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.13 1.372 . . . . 0.0 109.551 169.861 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 42.7 t -113.7 132.79 55.67 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.611 1.564 . . . . 0.0 110.691 169.631 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 67.3 m -126.55 122.13 34.24 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.948 0.899 . . . . 0.0 110.852 179.574 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 24.8 m-85 -134.26 156.13 48.96 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 126.701 2.0 . . . . 0.0 110.682 169.515 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 64.1 p -133.92 143.23 48.1 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.665 1.186 . . . . 0.0 110.594 169.336 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -147.07 144.08 28.82 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.058 1.343 . . . . 0.0 111.21 -176.779 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 23.1 p -70.93 -26.28 63.13 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.378 1.471 . . . . 0.0 112.281 172.048 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 11.3 m -53.06 138.89 29.74 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 126.841 2.056 . . . . 0.0 111.93 170.016 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -63.12 -31.21 72.3 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.658 1.183 . . . . 0.0 112.034 178.409 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.6 m -157.73 159.79 37.21 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 126.201 1.8 . . . . 0.0 110.921 175.003 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 52.1 p90 -160.06 162.22 34.11 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.731 1.612 . . . . 0.0 110.774 -173.409 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 58.2 t -95.94 129.35 46.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 C-N-CA 124.503 1.121 . . . . 0.0 108.24 175.29 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 19.4 tp -107.59 139.72 41.7 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.417 1.087 . . . . 0.0 109.923 172.592 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 13.6 m-80 -132.78 149.84 52.23 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.524 1.529 . . . . 0.0 111.107 -168.997 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 18.3 t90 -121.73 137.89 54.58 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.035 1.334 . . . . 0.0 111.617 -179.055 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -137.43 145.33 43.03 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 -172.836 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -102.03 139.76 37.22 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.021 1.328 . . . . 0.0 108.274 167.01 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 32.8 mtp -84.26 142.75 30.02 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.107 0.867 . . . . 0.0 112.11 176.862 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 45.6 m -91.17 158.4 41.41 Favored Pre-proline 0 CA--C 1.548 0.883 0 C-N-CA 124.843 1.257 . . . . 0.0 111.68 174.867 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -55.43 -33.45 85.89 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 123.947 3.098 . . . . 0.0 114.346 177.245 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.3 m -76.99 6.31 6.52 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.904 1.282 . . . . 0.0 113.895 177.374 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 74.02 20.93 2.69 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 127.208 2.203 . . . . 0.0 112.895 -178.188 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 20.7 mm100 -88.63 -172.89 3.92 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.185 0.994 . . . . 0.0 110.258 169.658 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.6 p -145.48 142.69 29.47 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.663 1.585 . . . . 0.0 110.323 -174.805 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -119.93 130.55 54.85 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 124.578 1.151 . . . . 0.0 111.17 175.493 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -77.97 125.75 29.81 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.364 1.065 . . . . 0.0 111.089 -177.12 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 55.7 mt -99.81 -49.31 4.4 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 125.172 1.389 . . . . 0.0 111.278 -172.658 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -162.6 173.16 14.3 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.249 1.819 . . . . 0.0 110.479 -178.006 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.18 163.34 36.11 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.074 1.35 . . . . 0.0 111.733 -178.215 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -145.62 124.08 6.52 Favored Pre-proline 0 CA--C 1.546 0.825 0 C-N-CA 124.833 1.253 . . . . 0.0 110.676 172.229 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.39 158.43 19.09 Favored 'Cis proline' 0 CA--C 1.538 0.681 0 CA-C-N 119.48 0.85 . . . . 0.0 112.761 -12.949 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -75.53 94.77 3.2 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 121.845 0.831 . . . . 0.0 110.591 179.176 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -91.56 -3.55 56.34 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.006 1.722 . . . . 0.0 114.548 -174.042 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 57.2 mtp180 -73.8 -54.81 7.19 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.69 1.196 . . . . 0.0 113.22 -168.703 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 34.4 m 61.09 10.9 3.12 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 126.039 1.736 . . . . 0.0 114.124 -176.134 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -135.82 164.85 40.37 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 127.668 2.387 . . . . 0.0 110.262 -171.302 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -67.99 169.64 16.02 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 123.352 2.702 . . . . 0.0 112.119 174.094 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 113.88 -1.68 24.39 Favored Glycine 0 CA--C 1.535 1.298 0 C-N-CA 124.941 1.258 . . . . 0.0 114.064 -171.747 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -97.48 157.43 16.01 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.21 1.404 . . . . 0.0 109.975 168.649 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -141.6 153.6 44.89 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.454 1.501 . . . . 0.0 110.173 172.984 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 54.4 p -63.68 -15.92 59.65 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.197 0.999 . . . . 0.0 113.405 175.009 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 41.6 mmm-85 -71.43 -16.71 62.39 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.276 1.43 . . . . 0.0 113.091 173.786 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 -108.05 135.3 49.64 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.789 1.236 . . . . 0.0 111.046 177.82 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 49.7 ttp180 -138.11 136.95 37.23 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.679 1.591 . . . . 0.0 110.609 -176.242 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 87.3 t -126.43 130.25 71.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 C-N-CA 125.633 1.573 . . . . 0.0 109.157 175.579 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 87.1 m -130.58 130.34 43.92 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.117 1.367 . . . . 0.0 110.281 -176.363 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -82.87 133.97 35.11 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.16 0.984 . . . . 0.0 110.195 173.652 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 28.4 mt -86.63 160.33 50.67 Favored Pre-proline 0 CA--C 1.543 0.697 0 C-N-CA 123.587 0.755 . . . . 0.0 111.339 176.659 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -62.49 -8.23 12.44 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 123.374 2.716 . . . . 0.0 114.187 174.75 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -65.77 -22.34 66.57 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-N 119.207 0.912 . . . . 0.0 112.602 169.271 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 80.66 -34.33 2.3 Favored Glycine 0 N--CA 1.473 1.167 0 C-N-CA 128.232 2.825 . . . . 0.0 113.914 175.871 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? -122.62 73.64 1.14 Allowed 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.743 1.617 . . . . 0.0 108.663 168.191 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -177.64 140.82 0.27 Allowed 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 128.495 2.718 . . . . 0.0 108.432 176.651 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -143.64 153.26 42.33 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 -168.666 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 21.4 m170 -108.67 131.72 54.63 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.341 1.456 . . . . 0.0 110.845 168.556 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -113.95 120.25 40.03 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 126.612 1.965 . . . . 0.0 108.157 176.691 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.2 t -128.31 127.17 42.22 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -168.383 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 47.8 t -91.17 116.39 32.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 125.441 1.496 . . . . 0.0 107.08 169.117 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 61.0 t -83.96 120.26 34.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 124.637 1.175 . . . . 0.0 109.638 -175.784 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 52.15 65.73 1.42 Allowed 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.228 1.811 . . . . 0.0 111.567 179.167 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.66 147.59 51.65 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.717 1.207 . . . . 0.0 112.628 -171.507 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 54.7 mmm-85 -122.72 165.31 16.75 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.971 1.709 . . . . 0.0 110.578 178.475 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 34.9 mtp180 -55.11 -33.88 63.21 Favored 'General case' 0 N--CA 1.483 1.217 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 -173.15 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -62.12 -18.54 61.13 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 125.241 1.417 . . . . 0.0 114.637 175.28 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 -81.21 -12.65 59.11 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 119.582 1.083 . . . . 0.0 113.316 176.903 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 20.9 m -62.64 138.63 58.54 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 119.517 1.053 . . . . 0.0 112.438 -179.486 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 154.74 -166.93 32.53 Favored Glycine 0 N--CA 1.473 1.124 0 O-C-N 121.377 -0.827 . . . . 0.0 113.611 -177.033 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 6.4 m -93.9 144.35 25.52 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.334 1.054 . . . . 0.0 110.366 -178.844 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 68.9 m-85 -142.96 155.51 44.7 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.354 1.461 . . . . 0.0 111.681 -177.989 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.4 pp -153.5 173.43 15.71 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.37 1.068 . . . . 0.0 112.593 177.933 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 28.1 t -125.6 156.13 39.63 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.813 1.645 . . . . 0.0 110.316 -176.209 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -152.74 137.02 5.64 Favored Glycine 0 N--CA 1.47 0.931 0 O-C-N 121.197 -0.939 . . . . 0.0 114.677 -179.188 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -110.02 152.1 26.34 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.736 1.214 . . . . 0.0 112.721 -179.506 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.5 tt -152.13 135.44 7.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 125.55 1.54 . . . . 0.0 110.442 173.634 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 33.7 m -67.04 159.65 28.26 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.775 0.83 . . . . 0.0 112.91 179.452 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 2.3 pp -72.05 -7.93 51.68 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 115.406 1.632 . . . . 0.0 115.406 -176.861 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -80.8 148.59 65.46 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 124.71 1.204 . . . . 0.0 112.082 177.156 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -68.66 -19.79 41.37 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 123.245 2.63 . . . . 0.0 113.355 -179.924 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -77.37 -9.56 58.92 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.798 1.239 . . . . 0.0 113.665 177.12 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.86 162.85 20.77 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.004 1.322 . . . . 0.0 113.785 -175.765 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -138.21 154.72 49.1 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.011 1.724 . . . . 0.0 109.368 175.857 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 45.8 mt -79.27 126.66 39.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 123.345 0.658 . . . . 0.0 110.838 -175.687 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -102.6 129.09 49.06 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.223 1.409 . . . . 0.0 109.38 169.375 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -104.11 149.42 25.24 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.742 1.217 . . . . 0.0 111.842 -174.386 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 88.1 p -91.62 170.03 10.26 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.661 1.356 . . . . 0.0 114.661 178.81 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 87.8 mt -68.27 127.77 34.13 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.033 0.933 . . . . 0.0 109.471 168.809 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.1 166.88 20.47 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 115.236 1.569 . . . . 0.0 115.236 -169.602 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -126.35 168.78 13.69 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.842 2.057 . . . . 0.0 111.234 169.574 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -120.57 142.16 49.62 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.301 1.44 . . . . 0.0 110.89 173.007 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 51.4 tp -110.16 131.24 55.23 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 126.082 1.753 . . . . 0.0 109.791 171.852 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -121.78 117.66 27.11 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.674 1.59 . . . . 0.0 109.395 169.955 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 39.5 t -104.18 111.84 35.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 C-N-CA 124.225 1.01 . . . . 0.0 108.665 170.949 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 71.8 p -86.69 151.3 23.53 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 126.087 1.755 . . . . 0.0 110.28 179.564 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -63.09 149.29 45.52 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.811 0.844 . . . . 0.0 112.805 -175.142 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 56.8 ttp180 -59.92 117.1 4.64 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 124.517 1.127 . . . . 0.0 109.697 -174.21 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 77.7 mtm-85 -70.61 152.67 43.65 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 -168.096 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -70.09 154.24 42.17 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.546 1.139 . . . . 0.0 112.447 175.053 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 . . . . . 0 C--O 1.254 1.293 0 C-N-CA 125.011 1.324 . . . . 0.0 114.451 176.921 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 75.0 mtm . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 116.506 -1.712 . . . . 0.0 111.875 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -71.19 160.92 47.54 Favored 'Trans proline' 0 CA--C 1.545 1.048 0 C-N-CA 122.438 2.092 . . . . 0.0 111.665 176.243 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -69.39 133.6 26.64 Favored 'Trans proline' 0 CA--C 1.537 0.655 0 C-N-CA 123.375 2.717 . . . . 0.0 111.322 176.276 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 37.3 p -153.11 151.61 30.37 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 125.436 1.494 . . . . 0.0 111.916 -172.452 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -121.93 134.39 54.84 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.382 1.473 . . . . 0.0 109.912 173.936 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.9 m -140.85 156.39 68.73 Favored Pre-proline 0 N--CA 1.479 1.016 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 179.523 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -70.17 158.16 92.51 Favored 'Cis proline' 0 C--N 1.352 0.733 0 CA-C-N 119.494 0.855 . . . . 0.0 110.926 -8.646 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -56.96 -32.01 65.6 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 172.715 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 49.2 tp -139.13 121.17 15.66 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.351 1.46 . . . . 0.0 109.322 170.031 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 49.4 tp -102.19 126.93 49.3 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.351 1.46 . . . . 0.0 109.205 171.019 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.6 t -110.75 124.64 67.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 124.081 0.952 . . . . 0.0 108.454 172.011 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 36.0 m -127.52 168.83 19.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 124.618 1.167 . . . . 0.0 111.677 174.174 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 44.0 m -94.54 146.41 24.12 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.869 1.267 . . . . 0.0 110.151 170.915 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -57.13 117.65 4.24 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.474 1.51 . . . . 0.0 111.867 -178.973 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 100.26 -2.9 56.53 Favored Glycine 0 CA--C 1.534 1.268 0 C-N-CA 125.919 1.723 . . . . 0.0 114.58 -175.937 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -86.21 157.27 20.01 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.232 1.516 . . . . 0.0 112.286 173.988 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -83.25 113.48 20.71 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.006 0.923 . . . . 0.0 110.44 175.773 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -95.82 116.63 29.19 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.101 0.961 . . . . 0.0 110.837 -178.754 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 36.1 m -121.5 127.49 51.09 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.763 0.825 . . . . 0.0 111.558 -177.014 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -100.66 150.42 22.75 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.07 1.748 . . . . 0.0 110.896 170.625 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 27.3 m -93.15 137.88 32.08 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 125.917 1.687 . . . . 0.0 108.179 169.337 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 42.9 t -143.88 131.19 20.85 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.9 1.28 . . . . 0.0 110.37 -176.356 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.9 t -128.27 136.09 50.54 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 121.321 -0.862 . . . . 0.0 112.058 -169.663 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -145.48 156.21 43.58 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.786 1.634 . . . . 0.0 113.464 174.504 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.2 t -148.42 139.06 22.83 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.898 1.679 . . . . 0.0 108.348 168.184 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -141.03 147.53 38.79 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.277 1.031 . . . . 0.0 112.314 -171.988 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 7.7 p -79.0 68.59 4.98 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 126.868 2.067 . . . . 0.0 110.697 176.424 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.1 t -156.87 165.07 37.24 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.319 1.448 . . . . 0.0 111.618 -173.211 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -74.6 -20.91 59.74 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.135 0.974 . . . . 0.0 112.303 169.95 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.6 m -171.59 163.11 6.61 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.955 2.102 . . . . 0.0 112.146 178.503 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 54.4 p90 -147.31 154.71 41.28 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.594 1.158 . . . . 0.0 111.787 176.154 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.4 t -95.95 129.39 46.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 125.204 1.402 . . . . 0.0 107.275 172.927 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 57.8 tp -99.39 134.72 41.85 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 124.167 0.987 . . . . 0.0 109.528 173.984 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 -127.84 155.39 44.2 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.107 1.363 . . . . 0.0 110.641 -177.922 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 10.1 t90 -125.36 137.3 54.03 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.634 1.174 . . . . 0.0 111.628 178.868 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -132.81 150.93 52.11 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.228 1.411 . . . . 0.0 113.347 -176.392 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -112.73 141.5 46.45 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.794 1.638 . . . . 0.0 109.178 168.992 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 81.2 mmm -74.19 133.39 42.73 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.057 0.543 . . . . 0.0 111.34 173.755 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 50.0 m -86.04 157.52 56.85 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 124.65 1.18 . . . . 0.0 111.783 172.807 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -57.57 -28.25 80.34 Favored 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 123.905 3.07 . . . . 0.0 114.284 174.97 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 25.2 p -77.03 3.81 11.51 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 126.022 1.729 . . . . 0.0 114.033 174.868 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 67.53 20.96 9.65 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 127.308 2.243 . . . . 0.0 112.932 -174.021 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -90.13 -172.65 3.56 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.958 1.303 . . . . 0.0 109.925 169.045 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.0 p -138.98 145.65 39.97 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.025 1.33 . . . . 0.0 110.347 -177.717 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -122.67 134.56 54.48 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 123.775 0.83 . . . . 0.0 111.569 173.154 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -75.23 137.52 41.3 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.96 0.904 . . . . 0.0 111.174 179.406 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 52.0 mt -114.55 -39.78 3.73 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.384 1.474 . . . . 0.0 112.865 -169.916 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -171.7 175.29 4.03 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.619 1.968 . . . . 0.0 110.175 -176.126 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -157.06 167.72 29.61 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.936 1.294 . . . . 0.0 112.096 179.844 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -145.23 115.44 4.99 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 125.76 1.624 . . . . 0.0 109.378 169.345 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_exo -53.44 148.7 15.41 Favored 'Cis proline' 0 C--N 1.352 0.713 0 CA-C-N 120.22 1.114 . . . . 0.0 113.546 -5.573 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -67.08 152.78 45.14 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 -170.221 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.1 t0 -142.93 140.55 31.18 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.597 1.559 . . . . 0.0 111.714 -172.363 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.4 mmm180 -101.73 -77.62 0.55 Allowed 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.777 1.231 . . . . 0.0 111.031 173.163 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 41.1 m 59.36 -58.56 0.05 Allowed 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 128.616 2.766 . . . . 0.0 117.639 169.815 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -135.87 157.06 76.75 Favored Pre-proline 0 CA--C 1.544 0.74 0 C-N-CA 126.391 1.876 . . . . 0.0 112.25 -170.68 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -61.45 147.73 94.73 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 122.765 2.31 . . . . 0.0 110.099 166.779 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 104.09 -17.15 48.92 Favored Glycine 0 N--CA 1.47 0.931 0 C-N-CA 124.357 0.98 . . . . 0.0 112.989 -179.823 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -83.55 62.94 7.1 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 118.13 0.965 . . . . 0.0 110.255 168.963 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -70.51 154.15 42.17 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.494 1.518 . . . . 0.0 112.859 -178.897 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 26.8 t -59.68 -23.07 62.79 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.001 1.32 . . . . 0.0 113.784 -177.16 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 30.4 ptt-85 -68.43 -23.0 64.57 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 113.893 1.072 . . . . 0.0 113.893 178.597 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 84.6 m-85 -93.83 123.41 37.16 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.488 1.115 . . . . 0.0 110.013 176.078 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -139.02 144.68 38.98 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.146 0.978 . . . . 0.0 111.645 -175.267 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 57.5 t -126.55 126.73 69.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 125.36 1.464 . . . . 0.0 109.379 -179.428 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 86.4 m -130.53 137.75 49.87 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.876 1.271 . . . . 0.0 110.421 -176.109 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -82.17 141.93 32.63 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.358 0.599 . . . . 0.0 112.459 172.249 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 39.2 mt -77.9 161.05 72.67 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 123.419 0.687 . . . . 0.0 110.898 169.37 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -68.37 -4.16 12.32 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 123.435 2.757 . . . . 0.0 113.562 171.699 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.81 -23.05 65.98 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 124.33 1.052 . . . . 0.0 112.494 172.005 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 93.66 -18.43 56.52 Favored Glycine 0 N--CA 1.477 1.428 0 C-N-CA 125.646 1.593 . . . . 0.0 114.715 170.695 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 27.1 ptt180 -154.59 73.66 0.91 Allowed 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 126.085 1.754 . . . . 0.0 109.204 170.08 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -173.8 147.53 1.36 Allowed 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 128.308 2.643 . . . . 0.0 108.462 -178.461 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 25.0 m-85 -146.86 157.08 43.56 Favored 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 113.958 1.096 . . . . 0.0 113.958 -166.383 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -116.55 143.09 46.04 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.193 1.797 . . . . 0.0 110.744 169.014 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 39.8 mtt -126.85 120.64 29.74 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.975 1.31 . . . . 0.0 109.95 177.615 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 69.0 m -120.42 128.21 52.98 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 114.263 1.208 . . . . 0.0 114.263 -168.041 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 21.6 t -94.6 98.88 8.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 N-CA-C 105.958 -1.868 . . . . 0.0 105.958 167.017 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 92.8 t -70.5 125.43 28.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.597 1.159 . . . . 0.0 109.182 -179.035 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 75.8 ttt180 52.35 65.59 1.46 Allowed 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.21 1.404 . . . . 0.0 110.929 179.181 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.26 130.57 43.29 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 121.327 -0.858 . . . . 0.0 111.721 -172.281 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 8.1 mpt_? -95.3 161.83 13.93 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.594 1.558 . . . . 0.0 110.086 175.266 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 89.8 mtm-85 -53.4 -36.92 61.98 Favored 'General case' 0 N--CA 1.482 1.141 0 O-C-N 121.151 -0.968 . . . . 0.0 112.708 179.732 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -62.35 -16.03 51.94 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.045 1.738 . . . . 0.0 114.845 176.264 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -80.53 -11.16 59.7 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 119.958 1.254 . . . . 0.0 113.272 176.234 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 21.2 m -63.91 132.23 50.12 Favored 'General case' 0 N--CA 1.477 0.878 0 O-C-N 120.534 -1.354 . . . . 0.0 112.586 -179.803 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 158.96 -167.32 34.79 Favored Glycine 0 N--CA 1.472 1.042 0 O-C-N 121.162 -0.961 . . . . 0.0 113.725 -177.68 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.2 m -93.4 138.31 31.86 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.888 1.275 . . . . 0.0 110.721 -178.045 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -135.9 156.46 48.73 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.804 1.641 . . . . 0.0 112.556 -177.647 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -160.25 148.62 16.82 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.808 1.243 . . . . 0.0 112.332 179.184 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 4.5 m -89.13 170.49 10.57 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.293 0.568 . . . . 0.0 111.999 172.49 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -155.04 115.6 0.67 Allowed Glycine 0 CA--C 1.526 0.765 0 C-N-CA 124.532 1.063 . . . . 0.0 111.673 168.435 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -87.82 156.26 19.48 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 117.791 0.795 . . . . 0.0 111.638 172.458 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 17.8 tt -154.43 130.19 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 124.602 1.161 . . . . 0.0 110.791 174.297 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 22.8 m -67.92 159.28 30.85 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.648 1.179 . . . . 0.0 113.402 -178.25 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.81 -9.91 48.34 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 115.578 1.696 . . . . 0.0 115.578 179.012 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -75.05 142.93 76.65 Favored Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 124.335 1.054 . . . . 0.0 112.265 -179.142 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_exo -56.14 -27.75 66.96 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 123.607 2.871 . . . . 0.0 114.658 174.736 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -84.51 0.98 47.78 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.819 1.248 . . . . 0.0 114.309 -179.49 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.88 164.52 17.26 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 124.4 1.08 . . . . 0.0 113.683 -177.213 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -146.1 152.44 39.31 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.76 1.624 . . . . 0.0 109.424 178.681 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 64.9 mt -71.46 123.37 25.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 124.28 1.032 . . . . 0.0 111.023 -174.774 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -83.72 88.38 7.07 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.451 1.501 . . . . 0.0 110.742 178.268 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -74.86 152.86 38.88 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.882 0.873 . . . . 0.0 110.566 171.353 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 58.8 m -157.35 -177.39 6.56 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.104 1.362 . . . . 0.0 112.24 179.528 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.5 tt -55.65 106.96 0.29 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.316 1.846 . . . . 0.0 113.083 -170.627 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.33 156.52 15.54 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.8 1.64 . . . . 0.0 114.762 -175.538 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -118.77 169.65 9.66 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 126.865 2.066 . . . . 0.0 111.558 177.559 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -130.82 144.94 51.81 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.844 1.257 . . . . 0.0 111.821 179.605 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 55.1 tp -115.21 134.8 54.81 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 126.417 1.887 . . . . 0.0 110.178 173.771 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 60.0 ttt85 -125.9 120.62 30.89 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.791 1.636 . . . . 0.0 109.755 171.207 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 46.6 t -106.43 114.71 46.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 124.833 1.253 . . . . 0.0 108.763 174.9 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 70.3 p -98.64 146.04 26.25 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.948 1.699 . . . . 0.0 110.416 -177.972 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 -59.05 146.98 36.48 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -172.355 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 20.0 ttp-105 -72.7 124.58 25.6 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 124.594 1.158 . . . . 0.0 108.803 -176.036 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 33.9 ptt-85 -143.2 160.23 40.84 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.342 1.057 . . . . 0.0 113.122 -166.97 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -72.94 154.29 40.61 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.625 1.17 . . . . 0.0 112.553 175.349 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 . . . . . 0 C--O 1.254 1.301 0 C-N-CA 127.273 2.229 . . . . 0.0 113.409 176.696 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 25.6 ptp . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 118.418 -0.801 . . . . 0.0 111.394 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_exo -59.89 162.48 15.96 Favored 'Trans proline' 0 CA--C 1.545 1.051 0 C-N-CA 123.955 3.103 . . . . 0.0 113.088 173.95 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -51.4 117.16 3.2 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 124.659 3.573 . . . . 0.0 113.392 177.81 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.2 t -158.96 155.05 26.88 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.147 1.379 . . . . 0.0 112.016 -175.541 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -129.45 132.92 47.07 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.002 1.721 . . . . 0.0 110.761 -171.05 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 92.8 p -140.86 154.99 69.22 Favored Pre-proline 0 CA--C 1.55 0.98 0 N-CA-C 113.893 1.071 . . . . 0.0 113.893 -172.283 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -66.98 160.07 79.03 Favored 'Cis proline' 0 C--N 1.353 0.804 0 CA-C-N 119.409 0.825 . . . . 0.0 111.497 -6.405 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.86 -28.68 66.33 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 176.521 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 47.8 tp -141.13 122.59 15.01 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.586 1.554 . . . . 0.0 109.049 170.252 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 54.6 tp -105.84 126.11 51.79 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.033 1.333 . . . . 0.0 109.32 170.926 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.4 t -109.08 123.77 65.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 124.028 0.931 . . . . 0.0 108.915 173.164 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.3 m -127.93 170.05 18.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 125.047 1.339 . . . . 0.0 111.474 172.86 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 18.4 m -98.16 151.74 20.1 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.472 1.509 . . . . 0.0 110.39 173.856 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -47.92 127.48 12.11 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.568 1.147 . . . . 0.0 111.45 168.777 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 86.24 -1.05 87.55 Favored Glycine 0 CA--C 1.532 1.137 0 C-N-CA 125.306 1.431 . . . . 0.0 114.664 -178.044 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.5 t0 -89.14 160.3 17.07 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.664 1.732 . . . . 0.0 111.912 173.786 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 71.4 m-20 -93.68 118.71 31.75 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.418 1.087 . . . . 0.0 110.191 175.343 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -97.88 120.44 38.28 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.875 1.27 . . . . 0.0 110.791 -179.992 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 23.1 m -125.38 125.82 44.03 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.593 0.757 . . . . 0.0 111.049 178.99 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -102.31 159.36 15.48 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.2 1.8 . . . . 0.0 111.034 172.078 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 71.3 m -113.4 126.82 55.77 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.722 1.609 . . . . 0.0 109.375 175.848 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -118.3 127.62 53.88 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.91 1.284 . . . . 0.0 111.525 179.012 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 57.6 m -118.91 139.36 51.77 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.983 1.313 . . . . 0.0 109.877 -172.278 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.427 ' CE1' HD21 ' A' ' 65' ' ' LEU . 38.1 m-85 -136.78 155.07 50.31 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -169.651 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.3 t -153.78 105.84 2.82 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.747 1.619 . . . . 0.0 108.02 168.262 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -118.25 154.7 31.82 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.682 1.193 . . . . 0.0 112.816 -169.388 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 13.6 t -73.06 -28.83 62.54 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.068 0.947 . . . . 0.0 110.9 167.658 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 17.1 m -56.9 116.16 3.02 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.269 1.828 . . . . 0.0 111.809 169.822 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -75.5 -20.43 58.75 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.162 0.985 . . . . 0.0 112.637 176.478 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 67.0 p -151.98 146.78 25.85 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.023 1.729 . . . . 0.0 109.686 171.812 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 30.8 p90 -165.91 160.88 17.23 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -168.607 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 57.6 t -95.99 132.59 39.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 125.482 1.513 . . . . 0.0 107.038 167.465 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.427 HD21 ' CE1' ' A' ' 56' ' ' PHE . 0.2 OUTLIER -99.31 113.48 25.81 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.849 0.86 . . . . 0.0 109.256 176.31 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 35.0 m120 -106.19 145.97 30.86 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.153 1.381 . . . . 0.0 111.177 179.91 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 18.5 t90 -114.83 136.36 53.18 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.669 1.188 . . . . 0.0 111.018 176.511 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -130.1 145.18 51.67 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.83 1.252 . . . . 0.0 113.998 -173.012 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 52.3 ttp85 -101.12 144.45 29.99 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 126.409 1.884 . . . . 0.0 107.64 167.017 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 33.5 mtp -90.26 145.79 24.73 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 118.948 0.794 . . . . 0.0 112.212 173.507 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 41.2 m -111.45 149.88 41.29 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 125.649 1.58 . . . . 0.0 111.071 173.805 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -69.32 -14.54 37.66 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 124.333 3.356 . . . . 0.0 114.164 -170.424 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.2 m -76.79 10.39 2.26 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.687 1.195 . . . . 0.0 112.929 171.162 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 68.15 48.82 0.9 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 127.434 2.294 . . . . 0.0 111.021 -176.565 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 26.9 mm-40 -130.72 175.71 8.8 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.441 1.496 . . . . 0.0 110.736 -178.523 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.0 p -136.13 150.99 49.32 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.938 1.695 . . . . 0.0 111.107 -177.354 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 39.6 t0 -133.99 127.72 32.93 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.573 1.549 . . . . 0.0 110.745 -177.798 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 30.6 ttmt -74.23 129.05 37.08 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.689 0.796 . . . . 0.0 110.734 -178.917 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 78.4 mt -101.35 -49.09 4.16 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 125.159 1.384 . . . . 0.0 112.294 -175.147 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -165.78 176.74 7.71 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 127.044 2.137 . . . . 0.0 109.409 -178.853 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -157.44 167.22 30.84 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.767 0.827 . . . . 0.0 113.003 -176.87 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -139.52 117.0 8.56 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 125.557 1.543 . . . . 0.0 109.4 169.405 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -55.08 154.52 20.26 Favored 'Cis proline' 0 C--N 1.352 0.73 0 CA-C-N 120.502 1.215 . . . . 0.0 113.656 -6.302 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -58.9 134.06 56.59 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.094 1.358 . . . . 0.0 113.741 -171.041 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -81.17 -0.79 41.95 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.671 1.189 . . . . 0.0 113.476 178.36 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 57.0 mtt85 -60.64 -9.53 4.0 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.53 1.932 . . . . 0.0 114.616 -177.644 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.4 p -65.43 -20.28 66.3 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.407 1.083 . . . . 0.0 113.01 169.452 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -116.44 152.97 48.74 Favored Pre-proline 0 CA--C 1.547 0.857 0 C-N-CA 125.717 1.607 . . . . 0.0 110.798 172.884 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -77.73 163.41 29.05 Favored 'Trans proline' 0 CA--C 1.538 0.698 0 C-N-CA 123.741 2.961 . . . . 0.0 111.453 175.737 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 98.23 18.36 26.71 Favored Glycine 0 CA--C 1.528 0.894 0 C-N-CA 124.159 0.885 . . . . 0.0 113.392 177.327 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 14.4 mm-40 -118.61 161.87 19.33 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.135 1.374 . . . . 0.0 111.003 173.811 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -142.91 136.19 28.37 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.261 1.024 . . . . 0.0 112.88 -173.3 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 51.1 m -69.2 -9.48 53.16 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 115.824 1.787 . . . . 0.0 115.824 -173.244 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 12.5 mmt85 -62.56 -20.34 64.59 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 119.728 1.149 . . . . 0.0 112.915 169.988 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -111.91 136.3 51.4 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.064 1.746 . . . . 0.0 110.081 174.311 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 12.1 mtm180 -144.52 149.26 35.61 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.7 1.2 . . . . 0.0 112.715 179.108 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 43.9 t -126.5 131.19 71.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 C-N-CA 125.69 1.596 . . . . 0.0 109.652 175.713 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 89.1 m -130.5 136.45 48.98 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.728 1.211 . . . . 0.0 110.407 178.269 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -80.28 141.89 35.08 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 118.566 0.621 . . . . 0.0 112.081 174.759 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 19.6 mt -85.48 158.62 57.15 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 123.751 0.82 . . . . 0.0 111.271 169.75 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -66.15 -4.55 10.58 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 123.656 2.904 . . . . 0.0 114.201 174.306 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -61.13 -26.15 67.48 Favored 'General case' 0 CA--C 1.551 1.007 0 CA-C-N 119.49 1.041 . . . . 0.0 112.835 169.699 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 98.73 -34.07 5.6 Favored Glycine 0 CA--C 1.531 1.078 0 C-N-CA 126.113 1.816 . . . . 0.0 114.224 172.708 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 57.1 mtm180 -135.36 73.59 1.48 Allowed 'General case' 0 N--CA 1.475 0.785 0 CA-C-O 122.616 1.198 . . . . 0.0 109.589 169.314 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -168.19 143.9 3.75 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 127.337 2.255 . . . . 0.0 108.651 -179.735 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -145.76 148.21 32.73 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.736 0.815 . . . . 0.0 112.833 -167.691 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -104.66 129.17 52.86 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.076 1.351 . . . . 0.0 110.673 168.827 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.4 mpt? -113.21 114.02 26.16 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 126.252 1.821 . . . . 0.0 108.987 -178.924 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 34.7 t -118.91 126.82 52.66 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.768 1.025 . . . . 0.0 113.768 -169.348 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 22.8 t -101.0 113.04 35.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 167.838 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 3.6 m -89.29 139.28 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-N 118.506 0.594 . . . . 0.0 111.864 179.424 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 19.9 tpt180 56.07 51.37 12.03 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.129 1.772 . . . . 0.0 111.712 173.658 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.12 158.96 24.49 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 114.589 1.329 . . . . 0.0 114.589 -168.81 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 4.8 ptm180 -135.77 151.83 50.5 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 127.816 2.446 . . . . 0.0 109.605 -172.159 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 36.1 mtp180 -53.35 -37.55 62.48 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 114.387 1.254 . . . . 0.0 114.387 -169.628 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -65.43 -13.79 59.49 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 125.053 1.341 . . . . 0.0 114.546 177.217 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -72.49 -16.69 61.79 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.978 1.263 . . . . 0.0 112.689 172.96 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.6 m -62.05 132.8 54.08 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.073 -1.017 . . . . 0.0 112.505 -177.388 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 159.76 -167.09 35.19 Favored Glycine 0 N--CA 1.473 1.112 0 C-N-CA 124.227 0.918 . . . . 0.0 114.031 -174.654 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.9 m -94.46 144.46 25.54 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.274 1.43 . . . . 0.0 110.977 -178.032 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -144.65 155.08 43.42 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.588 1.555 . . . . 0.0 111.789 -175.375 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -160.65 161.58 32.45 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.94 1.296 . . . . 0.0 113.441 179.511 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 3.5 m -104.67 162.74 13.02 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.342 1.457 . . . . 0.0 111.449 179.057 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -153.19 134.52 4.46 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 123.89 0.757 . . . . 0.0 113.369 169.883 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -99.27 126.78 45.17 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.981 0.913 . . . . 0.0 110.777 173.64 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 16.7 tt -122.28 131.36 73.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 O-C-N 121.266 -0.896 . . . . 0.0 110.857 174.888 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.2 m -61.22 157.96 15.11 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.515 1.126 . . . . 0.0 113.151 -177.92 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 39.0 mt -73.15 -14.23 61.33 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 -178.752 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -69.55 154.3 94.95 Favored Pre-proline 0 CA--C 1.552 1.055 0 C-N-CA 125.061 1.344 . . . . 0.0 112.821 176.097 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.87 -24.69 24.29 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 123.011 2.474 . . . . 0.0 112.975 176.958 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 17.2 ttpp -89.09 13.36 13.25 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 125.248 1.419 . . . . 0.0 113.461 -179.433 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.78 168.08 10.21 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.564 1.546 . . . . 0.0 114.754 -173.64 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -142.97 147.67 35.57 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.209 1.804 . . . . 0.0 109.219 177.372 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 42.8 mt -80.83 125.1 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 123.995 0.918 . . . . 0.0 111.006 -175.04 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 32.2 mmtm -88.05 93.92 9.64 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.955 1.302 . . . . 0.0 107.983 169.361 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -79.24 139.64 37.86 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.621 0.769 . . . . 0.0 112.021 -174.178 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 69.4 m -84.5 156.06 21.88 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.395 1.078 . . . . 0.0 113.33 175.073 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 89.0 mt -62.2 135.75 57.63 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 168.44 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.82 165.14 25.46 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 115.428 1.64 . . . . 0.0 115.428 -169.679 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -129.59 169.53 14.91 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 127.07 2.148 . . . . 0.0 110.55 169.548 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -122.46 142.33 50.67 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.818 1.247 . . . . 0.0 111.477 176.651 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 60.7 tp -110.34 136.27 49.77 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 125.946 1.698 . . . . 0.0 109.91 172.012 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 68.2 ttt180 -127.61 121.66 31.1 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.682 1.593 . . . . 0.0 109.756 170.07 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 45.2 t -108.0 111.85 37.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 C-N-CA 124.977 1.311 . . . . 0.0 108.641 172.755 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 75.4 p -90.8 155.2 18.96 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 125.945 1.698 . . . . 0.0 110.694 -179.647 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -65.21 148.9 50.86 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.946 0.898 . . . . 0.0 113.385 -172.463 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 34.2 ttp-105 -66.08 118.31 9.65 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 124.602 1.161 . . . . 0.0 109.828 -175.405 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 75.8 mtp85 -75.41 153.67 37.56 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.16 0.584 . . . . 0.0 112.418 -169.882 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -70.41 154.28 42.06 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.482 1.113 . . . . 0.0 112.442 174.66 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 . . . . . 0 C--O 1.253 1.283 0 C-N-CA 125.197 1.399 . . . . 0.0 112.97 177.304 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 39.7 ttp . . . . . 0 N--CA 1.489 1.486 0 CA-C-O 118.45 -0.786 . . . . 0.0 110.456 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_endo -66.82 167.4 19.61 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.962 2.441 . . . . 0.0 111.183 175.589 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -54.64 153.57 23.37 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 123.36 2.707 . . . . 0.0 114.081 178.873 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.8 t -147.98 145.6 28.61 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 125.271 1.429 . . . . 0.0 109.793 171.591 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -121.24 144.02 48.83 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.418 1.087 . . . . 0.0 112.301 -168.459 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 79.9 p -140.91 153.88 67.92 Favored Pre-proline 0 CA--C 1.547 0.85 0 N-CA-C 113.728 1.011 . . . . 0.0 113.728 168.732 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -70.43 159.92 90.9 Favored 'Cis proline' 0 C--N 1.352 0.738 0 CA-C-N 118.96 0.664 . . . . 0.0 111.092 -10.066 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.57 -30.44 69.79 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 173.05 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 48.0 tp -138.52 120.26 15.25 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.52 1.528 . . . . 0.0 109.005 170.103 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 41.8 tp -102.01 127.16 49.0 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.132 1.373 . . . . 0.0 109.403 172.781 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.8 t -112.43 123.1 67.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 124.022 0.929 . . . . 0.0 108.925 173.57 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.5 m -128.5 166.38 25.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 C-N-CA 124.687 1.195 . . . . 0.0 112.195 173.55 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.0 m -88.51 150.11 23.28 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.938 1.295 . . . . 0.0 110.522 172.339 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -51.73 124.95 13.6 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.587 1.155 . . . . 0.0 111.639 173.684 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 86.25 -0.87 87.48 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 124.849 1.214 . . . . 0.0 114.593 -178.412 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -85.62 158.92 19.97 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 119.598 1.699 . . . . 0.0 111.52 171.428 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 8.0 p30 -86.02 130.05 34.65 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.506 0.722 . . . . 0.0 111.276 172.145 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -111.07 119.58 39.5 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.325 1.45 . . . . 0.0 110.76 -178.161 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 34.4 m -120.55 125.57 48.15 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.985 0.914 . . . . 0.0 111.675 -176.482 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -99.99 153.12 19.45 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.739 1.615 . . . . 0.0 110.406 169.126 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 37.2 m -103.8 131.35 51.07 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.27 1.428 . . . . 0.0 108.858 171.583 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 46.4 t -121.29 124.21 44.06 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.979 1.312 . . . . 0.0 111.082 171.521 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 24.0 t -125.26 146.3 49.61 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.161 1.385 . . . . 0.0 111.181 179.964 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 34.6 p90 -160.59 156.17 25.29 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.07 1.348 . . . . 0.0 112.188 -170.042 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 69.4 m -138.92 101.38 4.28 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 121.323 -0.861 . . . . 0.0 110.961 169.026 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -78.31 145.7 35.18 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.493 0.717 . . . . 0.0 112.421 -179.212 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 19.0 m -76.03 -32.47 59.38 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.261 1.424 . . . . 0.0 111.467 173.375 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 51.3 p -81.57 -179.07 7.23 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.236 1.815 . . . . 0.0 112.721 173.351 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -139.07 131.37 28.37 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.753 1.621 . . . . 0.0 110.096 -179.827 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.4 t 82.07 117.72 0.05 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 128.482 2.713 . . . . 0.0 111.399 -175.771 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 5.0 p90 -169.18 164.12 11.05 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.141 1.376 . . . . 0.0 112.66 -167.675 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 48.0 t -109.61 137.85 39.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 126.286 1.834 . . . . 0.0 108.52 170.866 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 15.9 tp -102.94 130.79 50.12 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 123.641 0.776 . . . . 0.0 109.619 170.074 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -126.08 158.07 36.39 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.358 1.463 . . . . 0.0 111.568 -171.495 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 15.2 t90 -130.5 138.62 50.34 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.435 1.094 . . . . 0.0 112.149 -176.761 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -139.82 147.73 41.15 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.518 1.127 . . . . 0.0 113.436 -171.928 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 79.4 ttt-85 -110.93 138.29 47.51 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.542 1.537 . . . . 0.0 108.852 168.519 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 37.7 mtp -86.39 145.9 26.68 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 119.348 0.976 . . . . 0.0 112.492 177.046 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.1 p -86.01 163.0 44.98 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 123.824 0.849 . . . . 0.0 111.929 170.689 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -67.53 -19.45 48.59 Favored 'Trans proline' 0 C--N 1.354 0.85 0 C-N-CA 122.639 2.226 . . . . 0.0 112.575 171.574 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 21.9 m -82.41 12.54 4.38 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.135 1.374 . . . . 0.0 112.806 170.029 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . 0.312 0.4 OUTLIER 61.58 21.71 12.32 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 128.252 2.621 . . . . 0.0 115.574 179.185 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 17.7 mm100 -89.25 -172.68 3.73 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.072 0.949 . . . . 0.0 109.634 168.858 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.4 p -141.59 141.83 33.47 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.601 1.561 . . . . 0.0 110.318 -174.897 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -118.01 131.44 56.48 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 125.026 1.33 . . . . 0.0 110.369 175.582 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 55.4 tttm -83.07 119.42 24.46 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.554 1.141 . . . . 0.0 110.744 -174.285 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 74.6 mt -92.56 -49.45 6.1 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 124.731 1.213 . . . . 0.0 112.313 -169.206 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -172.55 175.32 3.53 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 127.005 2.122 . . . . 0.0 109.982 -173.206 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.61 172.15 18.32 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.992 1.317 . . . . 0.0 112.2 -178.686 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -143.5 118.42 6.24 Favored Pre-proline 0 CA--C 1.547 0.838 0 C-N-CA 124.809 1.244 . . . . 0.0 110.279 169.102 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -61.73 158.46 55.16 Favored 'Cis proline' 0 C--N 1.351 0.708 0 CA-C-N 119.154 0.733 . . . . 0.0 111.192 -10.183 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -74.96 94.5 2.84 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 122.05 0.928 . . . . 0.0 110.241 -179.86 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -76.6 -8.16 56.67 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.662 1.185 . . . . 0.0 114.16 -170.765 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 49.7 ptt85 -64.61 -32.2 73.75 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.434 1.493 . . . . 0.0 113.311 175.647 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.6 t 66.35 -61.18 0.3 Allowed 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 127.77 2.428 . . . . 0.0 113.214 -177.062 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -87.59 167.43 20.73 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 126.266 1.826 . . . . 0.0 110.797 173.605 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -56.61 132.75 53.68 Favored 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 123.378 2.718 . . . . 0.0 112.191 171.589 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -154.57 19.99 0.61 Allowed Glycine 0 N--CA 1.473 1.136 0 C-N-CA 124.503 1.049 . . . . 0.0 114.679 -177.798 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -163.04 169.89 18.83 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 126.804 2.041 . . . . 0.0 110.583 -169.822 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -82.15 158.99 23.43 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-O 121.45 0.643 . . . . 0.0 109.841 167.552 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.7 m -72.17 -1.97 17.0 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.449 1.1 . . . . 0.0 113.507 -179.421 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 84.4 mtt-85 -75.66 -35.08 60.49 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.643 1.577 . . . . 0.0 112.647 -179.33 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -91.7 116.35 28.81 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.454 1.101 . . . . 0.0 111.345 -169.65 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 -137.81 139.66 40.11 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.165 0.986 . . . . 0.0 111.029 -170.455 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 97.2 t -126.5 125.53 67.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 125.288 1.435 . . . . 0.0 109.487 -177.889 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 90.7 m -130.28 129.39 43.19 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.911 1.284 . . . . 0.0 110.935 -173.768 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -78.09 137.65 38.34 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.611 1.164 . . . . 0.0 111.188 178.291 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 51.0 mt -92.61 159.4 36.58 Favored Pre-proline 0 CA--C 1.545 0.772 0 C-N-CA 124.603 1.161 . . . . 0.0 111.823 177.437 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -64.96 -6.82 13.54 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 123.515 2.81 . . . . 0.0 113.993 173.573 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -68.43 -11.62 59.99 Favored 'General case' 0 CA--C 1.557 1.244 0 CA-C-N 119.336 0.971 . . . . 0.0 112.688 169.608 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 88.4 -34.16 3.91 Favored Glycine 0 N--CA 1.475 1.235 0 C-N-CA 126.964 2.221 . . . . 0.0 115.612 168.77 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 23.7 ptt-85 -140.5 73.61 1.43 Allowed 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 123.865 1.793 . . . . 0.0 109.925 172.008 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -169.54 137.83 1.84 Allowed 'General case' 0 C--O 1.237 0.446 0 C-N-CA 127.251 2.22 . . . . 0.0 107.195 -170.884 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 -143.86 137.97 28.3 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -167.642 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -92.28 126.07 37.2 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.432 1.093 . . . . 0.0 109.178 167.161 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 40.0 mtt -120.31 112.22 18.75 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 125.309 1.443 . . . . 0.0 108.793 -178.496 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 60.9 m -115.88 132.02 56.77 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 114.727 1.38 . . . . 0.0 114.727 -166.998 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 33.5 t -97.7 91.34 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 N-CA-C 105.777 -1.934 . . . . 0.0 105.777 166.743 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 86.0 t -73.54 121.48 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 123.764 0.825 . . . . 0.0 109.551 -178.971 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 59.39 73.88 0.46 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.007 1.723 . . . . 0.0 111.4 -175.675 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -79.97 147.86 31.41 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.372 1.469 . . . . 0.0 112.93 -175.91 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -116.48 162.75 17.1 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 126.904 2.082 . . . . 0.0 110.459 179.044 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 83.6 mtm-85 -56.18 -24.98 44.98 Favored 'General case' 0 N--CA 1.483 1.176 0 O-C-N 121.174 -0.954 . . . . 0.0 113.555 171.505 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -65.37 -25.36 67.54 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 124.816 1.246 . . . . 0.0 114.112 171.63 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -81.86 -26.69 34.01 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.924 0.89 . . . . 0.0 112.649 -179.622 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 45.4 m -48.78 133.0 17.89 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.337 1.055 . . . . 0.0 112.43 177.239 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 150.67 -162.0 29.19 Favored Glycine 0 N--CA 1.469 0.84 0 C-N-CA 123.839 0.733 . . . . 0.0 113.196 -172.784 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.9 m -96.1 140.86 30.21 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.289 1.436 . . . . 0.0 110.902 -172.706 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -134.13 156.22 48.68 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.642 1.577 . . . . 0.0 112.824 -177.159 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -155.17 156.19 35.26 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.264 1.426 . . . . 0.0 112.66 173.63 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -119.93 137.27 54.14 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.338 1.855 . . . . 0.0 109.847 176.144 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -141.74 132.44 5.25 Favored Glycine 0 N--CA 1.471 0.995 0 C-N-CA 124.086 0.851 . . . . 0.0 113.51 -171.556 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -88.52 156.18 19.23 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.025 0.93 . . . . 0.0 112.001 175.253 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 17.7 tt -154.08 133.7 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 124.889 1.276 . . . . 0.0 110.43 173.965 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 77.3 p -77.45 161.59 27.85 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.423 1.089 . . . . 0.0 113.135 178.427 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.82 -2.09 11.2 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 115.297 1.592 . . . . 0.0 115.297 178.479 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -73.03 145.74 86.56 Favored Pre-proline 0 CA--C 1.551 1.012 0 C-N-CA 124.287 1.035 . . . . 0.0 112.512 -177.101 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -56.53 -30.31 82.12 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 123.408 2.739 . . . . 0.0 113.949 172.794 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 59.7 mtpt -88.98 5.05 46.05 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.131 1.372 . . . . 0.0 114.059 -178.305 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.4 162.22 18.19 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.429 1.092 . . . . 0.0 113.848 -175.758 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -150.5 151.3 32.47 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.928 1.691 . . . . 0.0 109.185 -178.881 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 52.0 mt -68.93 122.57 20.57 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 123.685 0.794 . . . . 0.0 110.436 -177.512 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -80.83 88.4 5.84 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.91 1.284 . . . . 0.0 110.181 175.726 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -76.93 158.78 30.48 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.539 1.536 . . . . 0.0 112.879 -179.118 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 6.1 t -147.57 -170.22 3.51 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.821 0.848 . . . . 0.0 113.003 169.889 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 92.6 mt -68.93 127.77 34.29 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.984 1.714 . . . . 0.0 111.23 -177.488 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 10.7 mpt_? -68.51 159.64 31.39 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 126.236 1.814 . . . . 0.0 115.132 -168.851 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.91 169.68 9.05 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 127.256 2.222 . . . . 0.0 110.63 168.709 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -131.01 144.04 51.17 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.584 1.153 . . . . 0.0 112.334 -177.103 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 64.2 tp -112.93 137.62 51.04 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 126.374 1.87 . . . . 0.0 110.206 171.604 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 72.1 ttt180 -127.95 119.27 25.17 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.702 1.601 . . . . 0.0 109.851 169.812 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 41.5 t -100.89 118.68 47.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 124.673 1.189 . . . . 0.0 108.22 169.204 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 75.2 p -97.52 157.84 15.8 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.69 1.596 . . . . 0.0 110.785 178.955 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 56.7 mp0 -62.29 151.56 36.14 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.341 1.056 . . . . 0.0 112.332 -179.347 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 39.0 ttm105 -71.36 117.35 12.78 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 124.102 0.961 . . . . 0.0 110.332 -177.125 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 47.9 mtm105 -75.82 154.51 36.13 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.931 0.893 . . . . 0.0 112.26 -173.064 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -70.71 154.34 41.95 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.527 1.131 . . . . 0.0 112.403 174.499 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 . . . . . 0 C--O 1.252 1.226 0 C-N-CA 125.215 1.406 . . . . 0.0 112.99 177.109 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . 0.639 ' N ' ' HG ' ' A' ' 57' ' ' SER . 1.7 pmm? . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 118.788 -0.625 . . . . 0.0 111.545 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo -58.82 155.3 38.73 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 123.907 3.071 . . . . 0.0 112.115 169.946 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -67.57 126.73 15.24 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 123.385 2.723 . . . . 0.0 110.758 -179.244 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.3 t -153.51 156.87 38.91 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.978 0.911 . . . . 0.0 112.309 -175.573 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 57.4 t80 -150.56 118.2 6.15 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 127.217 2.207 . . . . 0.0 109.405 -174.495 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 98.2 p -140.94 160.87 56.7 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 124.49 1.116 . . . . 0.0 113.704 -170.632 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -70.64 164.0 82.87 Favored 'Cis proline' 0 C--N 1.354 0.859 0 CA-C-N 119.91 1.003 . . . . 0.0 111.548 -6.561 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.44 -23.57 66.97 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 175.0 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 44.4 tp -142.2 122.82 14.2 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.617 1.567 . . . . 0.0 108.785 171.024 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 61.4 tp -110.68 125.83 53.88 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.086 1.354 . . . . 0.0 109.07 170.685 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 12.6 p -108.04 128.37 63.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 123.969 0.907 . . . . 0.0 109.775 169.826 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.7 m -128.78 168.22 22.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 125.096 1.359 . . . . 0.0 111.716 172.924 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 88.4 m -90.72 148.83 22.33 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.372 1.069 . . . . 0.0 110.37 171.581 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -57.14 117.03 3.63 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.989 1.716 . . . . 0.0 111.174 175.743 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.0 5.62 65.91 Favored Glycine 0 CA--C 1.532 1.136 0 C-N-CA 125.464 1.506 . . . . 0.0 114.694 -175.252 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -97.06 158.16 15.56 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 119.435 1.618 . . . . 0.0 112.324 173.22 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 29.4 m120 -72.81 131.83 42.79 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.73 1.212 . . . . 0.0 111.199 173.845 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -117.86 114.01 22.62 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.562 1.145 . . . . 0.0 111.186 178.757 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 32.8 m -124.72 125.33 43.91 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.536 0.734 . . . . 0.0 111.905 -174.273 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -101.46 158.13 16.3 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.513 1.925 . . . . 0.0 110.4 169.965 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 28.1 m -102.67 137.39 40.96 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.349 1.46 . . . . 0.0 109.597 172.684 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 39.1 t -130.28 142.76 50.53 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.068 1.347 . . . . 0.0 111.812 170.498 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.9 m -140.61 128.07 21.33 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.009 0.524 . . . . 0.0 112.285 -174.233 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 26.4 m-85 -139.37 156.1 47.22 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 126.826 2.05 . . . . 0.0 113.412 175.764 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.639 ' HG ' ' N ' ' A' ' 33' ' ' MET . 53.3 m -136.82 134.55 37.1 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 126.977 2.111 . . . . 0.0 107.006 166.696 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -162.47 -179.52 7.01 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 116.658 2.096 . . . . 0.0 116.658 -169.688 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 72.4 p -78.38 -179.5 6.35 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 127.681 2.392 . . . . 0.0 112.901 -171.747 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 16.9 m 68.06 15.69 9.46 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 126.582 1.953 . . . . 0.0 113.9 174.947 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 77.87 -30.87 0.16 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 128.292 2.637 . . . . 0.0 112.103 -174.619 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -164.62 -178.01 5.11 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.76 1.224 . . . . 0.0 113.319 169.766 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 35.1 p90 -144.72 162.66 36.16 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.465 1.506 . . . . 0.0 112.843 -169.596 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.3 t -95.98 125.08 48.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 N-CA-C 106.277 -1.749 . . . . 0.0 106.277 168.474 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 19.5 tp -101.94 134.84 44.5 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 123.569 0.748 . . . . 0.0 110.037 175.28 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 8.6 m-80 -132.03 145.79 51.66 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.832 1.253 . . . . 0.0 110.903 -169.773 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 11.5 t90 -111.43 140.65 45.84 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 124.596 1.158 . . . . 0.0 111.374 178.289 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -133.78 140.29 46.85 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 -175.668 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 68.3 ttt180 -96.58 140.0 31.84 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.268 1.027 . . . . 0.0 108.742 167.834 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 33.3 mtp -97.02 145.92 25.49 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -177.085 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.8 p -85.49 163.77 43.21 Favored Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 123.717 0.807 . . . . 0.0 111.355 169.258 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -67.76 -18.4 47.62 Favored 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 122.661 2.24 . . . . 0.0 112.763 172.781 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 32.7 m -83.34 1.55 40.67 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.635 1.174 . . . . 0.0 112.91 170.861 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 74.46 22.44 2.13 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 127.784 2.433 . . . . 0.0 113.759 179.424 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -83.34 177.07 8.66 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.213 0.605 . . . . 0.0 109.463 168.399 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 11.7 p -144.22 139.1 28.5 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.841 1.257 . . . . 0.0 111.098 -169.904 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -122.51 130.11 52.7 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.028 0.931 . . . . 0.0 111.5 174.679 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -73.01 126.94 31.13 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.372 0.669 . . . . 0.0 111.021 -179.258 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 43.4 mt -98.27 -46.37 5.84 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.739 1.615 . . . . 0.0 111.989 -173.698 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -167.83 167.79 12.76 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 127.167 2.187 . . . . 0.0 109.784 -174.04 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -156.75 160.2 39.05 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.392 1.077 . . . . 0.0 112.372 -176.212 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -133.76 130.67 20.79 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 124.861 1.264 . . . . 0.0 110.21 170.607 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -66.1 150.03 78.51 Favored 'Cis proline' 0 C--N 1.351 0.673 0 CA-C-N 119.932 1.012 . . . . 0.0 111.473 -3.928 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -79.08 150.77 31.74 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.139 0.975 . . . . 0.0 112.672 -176.008 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -100.31 157.43 16.61 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 122.194 0.997 . . . . 0.0 112.26 174.487 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -87.47 -2.55 58.69 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.32 1.848 . . . . 0.0 113.193 -169.273 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 43.0 p -76.12 -6.33 50.72 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.186 1.794 . . . . 0.0 114.087 176.198 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 -58.42 149.27 60.91 Favored Pre-proline 0 CA--C 1.552 1.037 0 C-N-CA 125.555 1.542 . . . . 0.0 113.178 177.282 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -77.48 173.65 13.91 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.855 3.037 . . . . 0.0 111.919 178.122 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -87.76 1.51 85.41 Favored Glycine 0 CA--C 1.533 1.196 0 C-N-CA 124.453 1.025 . . . . 0.0 113.203 172.851 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -86.02 168.05 14.47 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.614 1.566 . . . . 0.0 111.008 176.702 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -67.51 128.6 37.06 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.277 -0.889 . . . . 0.0 111.211 173.553 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 40.4 p -86.51 -12.2 49.52 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 114.903 1.445 . . . . 0.0 114.903 -171.501 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 12.4 mtp85 62.43 -35.39 0.12 Allowed 'General case' 0 C--N 1.344 0.36 0 C-N-CA 130.67 3.588 . . . . 0.0 115.344 -174.52 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -118.3 140.47 49.78 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.137 1.775 . . . . 0.0 111.318 -174.156 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 31.4 ttp-105 -140.11 144.1 36.59 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.163 1.385 . . . . 0.0 111.465 -174.493 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 46.3 t -121.87 127.87 75.53 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 C-N-CA 124.887 1.275 . . . . 0.0 108.485 169.18 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 89.3 m -130.6 134.88 47.35 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.173 1.389 . . . . 0.0 110.403 -174.365 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 22.1 pt20 -79.92 141.66 35.86 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.574 0.749 . . . . 0.0 111.887 173.851 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 72.3 mt -93.9 158.38 36.44 Favored Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 124.904 1.282 . . . . 0.0 111.675 178.171 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -65.56 -4.72 10.13 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 123.549 2.832 . . . . 0.0 113.848 174.209 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 21.2 m120 -65.19 -18.53 65.39 Favored 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 119.15 0.886 . . . . 0.0 113.044 169.97 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 95.66 -34.14 5.07 Favored Glycine 0 N--CA 1.474 1.168 0 C-N-CA 126.457 1.98 . . . . 0.0 114.241 169.884 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 90.4 mtt-85 -141.41 73.65 1.43 Allowed 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.571 1.549 . . . . 0.0 109.173 169.308 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -164.82 144.81 7.28 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 126.787 2.035 . . . . 0.0 108.087 178.706 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -142.65 147.35 35.61 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 -168.055 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -105.19 138.63 41.08 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.163 1.385 . . . . 0.0 110.917 168.884 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 31.5 mtt -121.42 108.66 13.93 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 126.238 1.815 . . . . 0.0 107.816 179.32 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 17.5 t -122.26 128.35 51.0 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 -165.994 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 12.9 t -88.32 124.9 41.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 125.269 1.428 . . . . 0.0 107.356 168.073 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 67.4 t -84.29 112.48 21.61 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 C-N-CA 124.916 1.287 . . . . 0.0 108.887 174.535 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 80.7 mtt85 54.97 70.39 0.63 Allowed 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.714 1.605 . . . . 0.0 111.656 175.997 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.64 128.46 36.05 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.196 0.998 . . . . 0.0 111.792 -174.391 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 10.1 mpt_? -89.22 161.94 16.16 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.945 1.298 . . . . 0.0 109.828 173.557 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 71.8 mtm180 -58.73 -23.72 60.32 Favored 'General case' 0 N--CA 1.484 1.255 0 O-C-N 120.628 -1.295 . . . . 0.0 113.578 172.676 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -55.01 -26.88 40.02 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.576 1.551 . . . . 0.0 113.367 167.99 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 34.9 m-20 -95.73 -1.22 50.33 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.584 1.554 . . . . 0.0 113.207 -169.46 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 69.4 m -64.4 138.31 58.35 Favored 'General case' 0 CA--C 1.544 0.727 0 O-C-N 120.401 -1.437 . . . . 0.0 111.643 169.837 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 160.1 -167.41 35.47 Favored Glycine 0 N--CA 1.473 1.12 0 O-C-N 121.167 -0.958 . . . . 0.0 113.608 178.866 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.8 m -93.84 145.54 24.53 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.464 0.706 . . . . 0.0 110.004 175.701 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -139.56 158.99 43.19 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.85 2.06 . . . . 0.0 110.281 -178.671 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.9 pp -152.83 167.16 29.97 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.96 0.904 . . . . 0.0 112.558 171.095 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 50.4 t -114.32 144.76 42.73 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.676 1.591 . . . . 0.0 110.935 -178.767 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -147.79 139.04 7.49 Favored Glycine 0 N--CA 1.472 1.094 0 C-N-CA 124.031 0.824 . . . . 0.0 113.906 177.584 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -109.46 159.21 17.23 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.728 1.211 . . . . 0.0 112.387 179.161 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.4 tt -146.68 131.77 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 125.321 1.448 . . . . 0.0 109.355 169.377 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.3 m -67.29 152.33 45.91 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.449 1.1 . . . . 0.0 111.92 -177.905 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 3.7 pp -70.72 -11.5 60.98 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 115.372 1.619 . . . . 0.0 115.372 -170.936 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -74.32 148.03 85.77 Favored Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 123.808 0.843 . . . . 0.0 112.069 174.924 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -67.54 -18.74 48.94 Favored 'Trans proline' 0 CA--C 1.54 0.775 0 C-N-CA 123.189 2.593 . . . . 0.0 113.383 -179.015 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -76.83 -10.15 59.17 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.839 1.256 . . . . 0.0 113.718 176.433 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.25 162.32 20.29 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.931 1.292 . . . . 0.0 114.024 -175.106 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -137.92 157.96 45.33 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.109 1.764 . . . . 0.0 109.434 174.75 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 65.4 mt -72.91 132.55 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 123.386 0.674 . . . . 0.0 110.944 -177.986 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -122.34 135.29 54.69 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.772 2.029 . . . . 0.0 110.093 173.389 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -112.65 148.0 35.56 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.181 0.992 . . . . 0.0 113.524 -167.662 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 69.8 m -84.58 -175.45 5.79 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.428 1.491 . . . . 0.0 111.918 168.867 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -63.35 156.48 25.68 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.121 0.968 . . . . 0.0 110.552 168.924 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -93.84 155.45 17.19 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.17 0.988 . . . . 0.0 111.613 172.855 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -147.79 159.96 43.25 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.141 1.376 . . . . 0.0 112.291 -176.029 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -104.12 138.44 40.61 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.913 1.285 . . . . 0.0 112.046 -175.013 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 46.9 tp -109.91 126.7 54.15 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 125.998 1.719 . . . . 0.0 108.688 169.212 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 70.9 ttt180 -118.34 119.38 34.46 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.975 1.71 . . . . 0.0 109.603 175.531 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 43.8 t -104.09 120.39 54.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 C-N-CA 124.341 1.057 . . . . 0.0 108.582 170.367 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 68.1 p -98.9 150.07 22.29 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.308 1.443 . . . . 0.0 109.727 175.435 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 37.1 mp0 -50.73 150.49 2.83 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.978 1.311 . . . . 0.0 112.867 -177.971 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 57.7 ttp180 -63.15 126.84 28.7 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 124.449 1.099 . . . . 0.0 109.496 -178.11 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.39 147.43 48.52 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.092 0.405 . . . . 0.0 112.092 -170.58 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -70.78 154.31 41.96 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.512 1.125 . . . . 0.0 112.487 175.5 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 . . . . . 0 C--O 1.254 1.298 0 C-N-CA 125.417 1.487 . . . . 0.0 112.372 177.208 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 61.7 tpp . . . . . 0 N--CA 1.489 1.488 0 CA-C-O 118.293 -0.861 . . . . 0.0 110.1 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -74.85 168.2 25.35 Favored 'Trans proline' 0 CA--C 1.545 1.067 0 C-N-CA 123.484 2.789 . . . . 0.0 111.861 177.72 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -52.77 140.33 57.25 Favored 'Trans proline' 0 C--N 1.35 0.652 0 C-N-CA 124.321 3.348 . . . . 0.0 113.422 171.757 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 37.2 p -150.25 153.5 36.3 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.7 1.6 . . . . 0.0 111.067 179.609 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -121.46 134.13 55.07 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.255 1.422 . . . . 0.0 110.117 178.533 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.4 m -140.83 157.45 67.53 Favored Pre-proline 0 N--CA 1.477 0.892 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 179.918 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -70.64 157.87 94.14 Favored 'Cis proline' 0 C--N 1.351 0.662 0 CA-C-N 119.327 0.795 . . . . 0.0 110.887 -8.993 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -57.69 -32.7 67.62 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 172.146 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 50.6 tp -138.93 120.37 14.96 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.531 1.533 . . . . 0.0 109.342 170.733 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 50.6 tp -100.62 127.27 47.07 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.524 1.53 . . . . 0.0 109.24 171.146 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.7 t -111.52 124.61 68.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 124.099 0.96 . . . . 0.0 108.562 171.805 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.1 m -127.58 164.32 28.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 124.493 1.117 . . . . 0.0 111.562 173.959 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 16.8 m -88.33 151.27 22.73 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.681 1.193 . . . . 0.0 110.472 173.662 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.12 120.53 2.45 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.942 1.697 . . . . 0.0 112.563 171.634 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.18 1.08 89.64 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 125.868 1.699 . . . . 0.0 115.408 179.692 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -85.13 157.26 20.73 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 119.65 1.725 . . . . 0.0 111.914 175.744 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -82.54 123.53 29.29 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.696 0.798 . . . . 0.0 110.353 177.548 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -104.55 123.79 48.16 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.667 1.187 . . . . 0.0 110.928 -178.529 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 36.0 m -132.3 126.87 34.37 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.002 0.921 . . . . 0.0 111.516 -175.963 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -100.37 153.98 18.88 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 126.1 1.76 . . . . 0.0 110.837 171.027 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 39.4 m -101.53 128.41 47.79 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 125.266 1.426 . . . . 0.0 108.572 169.759 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 95.6 m -124.67 128.77 49.34 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.606 1.162 . . . . 0.0 109.538 170.603 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.9 m -111.0 127.85 55.66 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.744 0.818 . . . . 0.0 109.884 -173.923 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -146.17 141.98 28.0 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.239 1.016 . . . . 0.0 110.874 174.912 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 68.0 m -92.58 101.42 13.84 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 166.862 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -97.62 156.37 16.55 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.735 0.814 . . . . 0.0 112.97 -171.07 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 44.2 m -57.17 128.79 38.75 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 126.692 1.997 . . . . 0.0 111.507 -173.586 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 16.1 m -68.71 -22.98 64.31 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 -169.877 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -78.71 -57.39 3.78 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.367 1.067 . . . . 0.0 111.04 177.062 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 42.5 p -175.92 152.74 1.26 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.792 1.637 . . . . 0.0 111.849 -173.614 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 49.2 p90 -166.08 169.31 14.66 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.353 1.461 . . . . 0.0 112.051 -171.987 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 24.2 t -125.77 119.93 56.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 125.0 1.32 . . . . 0.0 107.878 168.648 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 59.0 tp -99.43 139.4 35.14 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 124.819 1.247 . . . . 0.0 108.662 169.601 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 9.7 m-80 -133.8 152.8 51.98 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.761 1.224 . . . . 0.0 111.193 -170.809 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 24.0 t90 -128.19 139.41 52.49 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.871 1.268 . . . . 0.0 111.04 175.469 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -135.31 143.41 46.16 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 114.677 1.362 . . . . 0.0 114.677 -170.404 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 55.9 ttp85 -93.14 144.46 25.26 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.913 1.685 . . . . 0.0 107.104 165.614 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 28.9 mtp -96.91 145.95 25.41 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 118.945 0.793 . . . . 0.0 112.244 172.62 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 59.3 m -102.89 158.64 31.35 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 125.029 1.331 . . . . 0.0 111.301 169.809 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_exo -56.6 -30.97 85.36 Favored 'Trans proline' 0 C--N 1.355 0.917 0 C-N-CA 124.405 3.403 . . . . 0.0 115.163 -172.97 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 14.3 m -77.02 11.86 1.62 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.001 1.32 . . . . 0.0 113.655 178.094 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 46.3 t30 69.12 25.4 5.81 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 127.164 2.186 . . . . 0.0 112.445 -176.913 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -92.72 170.51 9.66 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.203 1.001 . . . . 0.0 110.628 172.85 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 9.9 p -134.74 152.55 51.85 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.457 1.503 . . . . 0.0 111.555 -174.722 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 43.4 t0 -136.47 125.77 24.84 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.701 1.601 . . . . 0.0 110.042 -177.823 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 12.7 ttmm -75.05 126.13 30.38 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.235 0.541 . . . . 0.0 110.734 -175.875 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 91.0 mt -95.37 -49.43 5.45 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.248 1.419 . . . . 0.0 111.147 -177.8 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -160.82 176.72 11.16 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.41 1.484 . . . . 0.0 110.445 177.296 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -152.85 166.7 31.46 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.862 1.265 . . . . 0.0 112.043 -174.857 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -137.72 115.27 9.6 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 126.033 1.733 . . . . 0.0 109.117 172.587 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -55.9 157.51 22.1 Favored 'Cis proline' 0 C--N 1.352 0.715 0 CA-C-N 120.289 1.139 . . . . 0.0 113.935 -5.803 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -63.04 120.63 11.79 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 -170.526 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -87.58 -1.82 58.2 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.251 1.42 . . . . 0.0 111.749 167.975 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.38 -17.69 45.39 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.936 2.094 . . . . 0.0 113.574 -176.849 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 20.6 m -70.73 -15.11 62.67 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.589 1.156 . . . . 0.0 113.971 173.935 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -69.98 137.13 87.28 Favored Pre-proline 0 CA--C 1.547 0.834 0 O-C-N 121.166 -0.959 . . . . 0.0 110.363 175.233 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -70.81 134.5 25.89 Favored 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 122.746 2.298 . . . . 0.0 110.621 -176.21 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 103.43 -9.27 53.12 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 125.081 1.324 . . . . 0.0 113.184 -172.743 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 18.2 mm100 -79.03 152.77 30.73 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 118.195 0.998 . . . . 0.0 112.044 171.987 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -127.46 147.67 50.3 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.64 1.576 . . . . 0.0 111.324 177.686 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 25.0 m -71.22 -11.95 61.21 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 -174.34 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -67.52 -17.15 64.55 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 114.271 1.212 . . . . 0.0 114.271 -178.776 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -101.91 127.23 48.84 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.916 1.286 . . . . 0.0 110.118 176.498 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -134.2 143.12 47.67 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.412 1.085 . . . . 0.0 112.197 -171.133 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 26.0 t -126.56 127.7 70.54 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 125.14 1.376 . . . . 0.0 109.232 168.562 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 90.3 m -130.52 137.38 49.7 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.479 1.512 . . . . 0.0 110.779 -174.286 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 65.4 tt0 -86.02 134.73 33.83 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.119 0.968 . . . . 0.0 110.59 172.188 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 65.8 mt -87.13 158.92 52.07 Favored Pre-proline 0 CA--C 1.542 0.635 0 C-N-CA 124.203 1.001 . . . . 0.0 112.064 -179.281 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -63.97 -6.97 12.15 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 123.645 2.897 . . . . 0.0 114.017 173.8 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -64.58 -26.04 68.23 Favored 'General case' 0 CA--C 1.552 1.022 0 CA-C-N 119.559 1.072 . . . . 0.0 112.191 169.094 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 92.98 -34.04 4.75 Favored Glycine 0 CA--C 1.53 1.018 0 C-N-CA 126.556 2.027 . . . . 0.0 113.591 174.637 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 22.9 ptt180 -130.75 73.54 1.55 Allowed 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 122.835 1.302 . . . . 0.0 110.378 171.003 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -175.47 143.94 0.66 Allowed 'General case' 0 C--O 1.237 0.398 0 C-N-CA 127.393 2.277 . . . . 0.0 109.14 -177.663 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -142.51 148.31 37.43 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -168.782 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 10.0 m170 -107.31 134.88 49.73 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.26 1.424 . . . . 0.0 111.621 170.442 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -119.92 121.36 38.84 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 126.192 1.797 . . . . 0.0 107.923 178.002 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 22.7 t -133.78 137.04 44.93 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 116.285 1.958 . . . . 0.0 116.285 -166.721 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 48.4 t -96.58 116.26 38.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 C-N-CA 126.906 2.083 . . . . 0.0 107.318 168.265 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 88.5 t -76.83 127.29 37.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 123.657 0.783 . . . . 0.0 109.026 169.599 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 54.4 ttt85 54.75 71.33 0.54 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.931 1.693 . . . . 0.0 111.551 176.864 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -69.83 129.42 39.51 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.627 0.771 . . . . 0.0 110.98 -177.535 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 37.7 mmm-85 -103.74 161.91 13.53 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 126.019 1.727 . . . . 0.0 110.268 179.492 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 3.2 mmm180 -51.81 -34.28 39.37 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 121.009 -1.057 . . . . 0.0 113.418 -179.628 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -66.89 -19.49 65.74 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.408 1.483 . . . . 0.0 115.001 176.81 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -75.9 -13.7 60.26 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 119.831 1.196 . . . . 0.0 113.144 177.992 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.2 m -62.83 129.16 39.23 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 120.661 -1.275 . . . . 0.0 112.156 179.998 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 161.3 -166.46 35.84 Favored Glycine 0 CA--C 1.529 0.924 0 C-N-CA 124.111 0.863 . . . . 0.0 113.246 -173.583 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.6 m -96.83 144.28 26.94 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.664 1.186 . . . . 0.0 110.833 -177.244 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -143.03 158.29 43.74 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.363 1.865 . . . . 0.0 111.321 -175.553 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.2 pp -158.64 166.53 31.84 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.555 1.142 . . . . 0.0 112.208 174.295 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 71.3 m -113.61 162.12 16.6 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.889 1.275 . . . . 0.0 111.268 177.384 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -156.72 133.89 3.81 Favored Glycine 0 N--CA 1.471 0.977 0 O-C-N 121.529 -0.732 . . . . 0.0 114.12 176.462 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -114.52 147.85 38.79 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.285 1.034 . . . . 0.0 112.685 -178.451 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 16.9 tt -153.96 147.97 13.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.296 1.438 . . . . 0.0 111.035 -179.389 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 66.1 m -77.63 150.73 34.58 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 120.918 -1.114 . . . . 0.0 110.689 169.493 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.86 -4.9 37.72 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 115.413 1.635 . . . . 0.0 115.413 -174.333 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -75.05 147.18 83.3 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 124.68 1.192 . . . . 0.0 111.894 174.134 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -68.77 -17.14 42.31 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 123.434 2.756 . . . . 0.0 113.77 -176.613 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -73.66 -16.14 61.22 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.532 1.133 . . . . 0.0 113.575 176.268 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -71.67 168.1 18.43 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.137 1.375 . . . . 0.0 113.765 -176.052 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.54 149.06 35.24 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.125 1.77 . . . . 0.0 108.664 176.866 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 34.0 mt -75.48 121.61 27.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 123.893 0.877 . . . . 0.0 110.928 -175.123 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 36.6 tptt -81.81 115.31 20.97 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.683 0.793 . . . . 0.0 109.769 168.985 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -108.91 158.87 17.28 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.723 2.009 . . . . 0.0 110.587 174.226 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 5.6 t -143.96 -168.03 2.75 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.369 1.068 . . . . 0.0 112.156 176.384 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 98.7 mt -60.82 117.5 5.48 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.874 1.669 . . . . 0.0 111.884 -172.478 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 20.2 ptp180 -66.32 157.86 30.61 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.656 1.582 . . . . 0.0 113.632 -174.67 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -122.36 165.75 15.79 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 127.038 2.135 . . . . 0.0 111.52 -175.057 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -128.01 143.13 51.07 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.585 1.154 . . . . 0.0 111.885 -177.657 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 56.4 tp -113.27 135.94 53.29 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 126.196 1.798 . . . . 0.0 109.97 172.563 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -126.66 123.23 37.1 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.81 1.644 . . . . 0.0 109.539 169.726 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 46.5 t -103.01 124.35 57.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 107.143 -1.429 . . . . 0.0 107.143 169.275 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 67.5 p -101.3 155.3 18.12 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.313 1.445 . . . . 0.0 110.904 177.25 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -58.75 150.81 22.65 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.752 0.787 . . . . 0.0 112.845 178.645 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -75.57 130.32 38.63 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.323 1.049 . . . . 0.0 109.049 -179.471 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 44.9 ptt85 -66.96 163.04 20.62 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 -174.713 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -76.32 154.37 35.1 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.106 0.962 . . . . 0.0 111.359 168.611 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 . . . . . 0 C--O 1.254 1.325 0 C-N-CA 125.618 1.567 . . . . 0.0 112.391 170.804 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 22.9 mmt . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 118.705 -0.664 . . . . 0.0 111.09 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -58.83 159.26 21.6 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 124.451 3.434 . . . . 0.0 113.257 174.542 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -72.17 159.2 50.41 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 123.506 2.804 . . . . 0.0 111.888 175.656 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 85.5 m -141.42 150.46 42.37 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.272 1.429 . . . . 0.0 110.095 -177.242 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -145.08 114.45 7.11 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.152 1.781 . . . . 0.0 109.755 172.793 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 69.2 m -140.91 160.06 59.81 Favored Pre-proline 0 N--CA 1.479 0.976 0 C-N-CA 124.762 1.225 . . . . 0.0 113.069 -170.895 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -71.21 158.71 94.9 Favored 'Cis proline' 0 C--N 1.353 0.788 0 CA-C-N 120.152 1.09 . . . . 0.0 111.531 -4.261 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.55 -25.21 64.35 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 175.387 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 45.2 tp -142.45 122.55 13.73 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.445 1.498 . . . . 0.0 109.044 169.988 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 61.6 tp -108.74 125.47 51.96 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.21 1.404 . . . . 0.0 108.881 169.75 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 12.8 p -108.79 129.33 63.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 123.877 0.871 . . . . 0.0 109.653 169.629 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 28.5 m -130.23 163.09 36.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 124.952 1.301 . . . . 0.0 111.42 173.07 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 16.3 m -84.77 147.47 26.84 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.079 0.951 . . . . 0.0 109.963 170.223 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 64.7 tt0 -56.43 124.95 19.91 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 124.931 1.292 . . . . 0.0 110.696 173.524 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.91 -2.78 84.47 Favored Glycine 0 CA--C 1.532 1.139 0 C-N-CA 126.085 1.802 . . . . 0.0 114.781 -174.795 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -87.58 160.99 17.98 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 119.35 1.575 . . . . 0.0 111.748 172.263 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -87.05 121.44 29.51 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.328 1.051 . . . . 0.0 110.495 177.331 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -97.61 128.49 44.37 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.393 1.077 . . . . 0.0 110.601 177.481 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 97.0 m -132.68 127.05 33.97 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 119.336 0.971 . . . . 0.0 111.84 176.125 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -100.99 159.48 15.17 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.609 1.964 . . . . 0.0 110.409 169.302 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 59.1 m -103.8 134.28 47.38 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.144 1.378 . . . . 0.0 109.312 171.451 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 3.3 t -137.15 142.27 42.22 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.579 1.152 . . . . 0.0 112.366 177.943 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 90.5 p -147.05 154.18 40.87 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 121.065 -1.022 . . . . 0.0 113.115 -176.877 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -149.4 156.23 41.71 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 126.429 1.892 . . . . 0.0 112.34 -172.467 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.4 t -146.83 135.05 21.68 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.567 1.147 . . . . 0.0 109.259 168.926 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -140.6 134.08 29.99 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.251 1.02 . . . . 0.0 112.119 -169.83 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 13.9 m -63.04 -30.16 71.38 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 125.817 1.647 . . . . 0.0 112.415 177.155 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 12.6 p -69.48 -14.69 63.01 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.546 1.538 . . . . 0.0 114.168 174.222 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 71.92 -46.81 0.65 Allowed 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 128.845 2.858 . . . . 0.0 113.424 174.356 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 70.7 m -104.63 126.0 51.29 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.569 1.548 . . . . 0.0 111.252 178.327 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 55.6 p90 -155.55 157.61 37.11 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.6 1.16 . . . . 0.0 112.134 -174.382 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 48.8 t -95.98 127.86 47.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 125.154 1.381 . . . . 0.0 107.274 169.909 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.0 tt -99.37 119.75 38.47 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 173.277 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 23.2 m-80 -112.79 149.41 33.07 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.14 1.376 . . . . 0.0 111.146 179.349 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 11.5 t90 -119.25 142.1 48.34 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.72 1.208 . . . . 0.0 111.7 175.807 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -137.15 149.12 47.07 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.705 1.202 . . . . 0.0 113.769 -169.976 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 79.0 ttt-85 -108.04 140.28 41.44 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.397 1.479 . . . . 0.0 108.252 167.348 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 29.0 mtp -84.41 145.91 27.94 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.59 0.632 . . . . 0.0 112.35 178.345 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 66.0 m -107.64 153.2 41.57 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 125.266 1.426 . . . . 0.0 112.026 179.912 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -56.0 -30.03 76.34 Favored 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 124.69 3.593 . . . . 0.0 115.202 -177.286 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.3 m -76.98 10.16 2.49 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.843 1.257 . . . . 0.0 113.491 178.844 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 67.96 44.85 1.44 Allowed 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.825 2.05 . . . . 0.0 110.585 -175.223 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -124.09 -172.69 2.59 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.518 1.527 . . . . 0.0 109.946 177.892 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.2 p -146.01 148.13 32.38 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.719 1.608 . . . . 0.0 110.403 -174.333 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -124.69 132.59 53.39 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 124.126 0.97 . . . . 0.0 111.258 173.196 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 29.9 ttmt -76.2 126.0 30.19 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.684 1.193 . . . . 0.0 110.766 -179.41 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 66.3 mt -101.54 -51.98 3.33 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 125.501 1.52 . . . . 0.0 111.75 -170.412 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -160.46 160.86 32.6 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 127.009 2.123 . . . . 0.0 108.767 -171.963 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.57 165.4 32.95 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.65 0.78 . . . . 0.0 111.867 -174.936 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -138.19 115.61 9.31 Favored Pre-proline 0 CA--C 1.545 0.763 0 C-N-CA 124.678 1.191 . . . . 0.0 110.749 171.105 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -62.54 161.33 53.26 Favored 'Cis proline' 0 C--N 1.352 0.724 0 CA-C-N 119.253 0.769 . . . . 0.0 110.941 -11.659 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -68.35 94.45 0.54 Allowed 'General case' 0 CA--C 1.546 0.793 0 CA-C-O 122.082 0.944 . . . . 0.0 112.148 -173.602 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -88.73 -10.74 47.28 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.714 1.606 . . . . 0.0 112.891 174.895 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -75.67 -9.8 58.9 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.459 1.904 . . . . 0.0 113.629 172.501 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.5 t 98.49 154.7 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 130.113 3.365 . . . . 0.0 110.377 -172.671 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -53.64 158.77 2.87 Favored Pre-proline 0 CA--C 1.552 1.025 0 C-N-CA 125.719 1.608 . . . . 0.0 112.432 170.307 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -51.64 144.13 34.63 Favored 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 124.165 3.243 . . . . 0.0 113.912 179.474 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 139.71 -8.31 3.07 Favored Glycine 0 CA--C 1.535 1.314 0 C-N-CA 125.082 1.325 . . . . 0.0 114.774 -175.84 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.427 ' CD ' ' H ' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -92.14 -143.79 0.2 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.363 1.465 . . . . 0.0 108.786 168.995 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 47.2 t0 -75.63 71.55 2.53 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 120.575 -1.328 . . . . 0.0 110.201 168.789 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 19.5 m -60.55 -6.83 1.79 Allowed 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 126.834 2.054 . . . . 0.0 115.624 -171.304 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 48.6 mtm180 -57.74 -36.53 72.19 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.696 1.599 . . . . 0.0 113.388 176.149 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 80.3 m-85 -69.81 125.78 27.75 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.01 1.324 . . . . 0.0 111.24 173.025 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 8.2 tmm_? -144.47 139.9 28.59 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.55 1.54 . . . . 0.0 111.915 -169.623 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 65.2 t -119.31 133.46 66.06 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 C-N-CA 125.122 1.369 . . . . 0.0 110.378 172.462 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 45.2 m -127.16 134.42 50.18 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 125.509 1.523 . . . . 0.0 110.473 177.767 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -84.08 138.04 33.26 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.743 1.217 . . . . 0.0 111.022 175.459 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 45.6 mt -93.73 159.19 35.24 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 124.828 1.251 . . . . 0.0 111.695 177.768 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -65.56 -4.47 9.67 Favored 'Trans proline' 0 CA--C 1.542 0.92 0 C-N-CA 123.538 2.825 . . . . 0.0 114.293 174.976 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -68.23 -13.11 62.0 Favored 'General case' 0 CA--C 1.553 1.058 0 CA-C-N 119.454 1.025 . . . . 0.0 112.948 169.825 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 93.84 -34.12 4.83 Favored Glycine 0 N--CA 1.475 1.272 0 C-N-CA 126.66 2.076 . . . . 0.0 114.889 169.327 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 31.0 ptt-85 -146.12 73.63 1.34 Allowed 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 123.967 1.842 . . . . 0.0 110.138 169.792 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -161.58 141.03 10.12 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 128.872 2.869 . . . . 0.0 106.232 -176.349 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -146.09 148.5 32.7 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 -166.696 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 -100.08 122.33 42.78 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.182 1.393 . . . . 0.0 110.135 168.462 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -105.74 105.81 16.02 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 126.653 1.981 . . . . 0.0 108.291 179.975 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.2 m -114.69 145.6 41.85 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -168.704 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 11.0 t -116.82 106.41 20.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 126.588 1.955 . . . . 0.0 106.37 167.313 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 79.4 t -68.61 127.22 30.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 174.069 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 57.4 ttm-85 53.87 68.14 0.89 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.1 1.36 . . . . 0.0 111.457 170.74 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -70.76 138.21 50.28 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.0 0.92 . . . . 0.0 112.118 -173.883 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 8.7 mpt_? -107.67 158.63 17.11 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 126.028 1.731 . . . . 0.0 109.743 175.211 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 40.1 mtp180 -56.15 -32.27 64.13 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 -172.245 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 5.0 p-10 -64.67 -18.68 65.19 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 114.998 1.481 . . . . 0.0 114.998 175.955 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -71.62 -24.78 61.94 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.085 0.857 . . . . 0.0 112.317 177.169 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 19.3 m -54.71 141.55 31.86 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.254 1.022 . . . . 0.0 112.746 -178.37 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 146.98 -163.77 28.61 Favored Glycine 0 N--CA 1.471 1.029 0 C-N-CA 124.432 1.015 . . . . 0.0 113.083 -174.414 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.3 m -92.0 141.04 29.05 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.406 1.082 . . . . 0.0 110.599 -178.308 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 33.6 m-85 -132.57 159.63 38.92 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.779 2.032 . . . . 0.0 110.942 178.818 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -166.25 155.84 11.76 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.61 1.564 . . . . 0.0 112.033 179.909 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 30.8 m -99.53 159.93 14.66 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.873 0.869 . . . . 0.0 112.036 172.86 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -148.06 122.12 1.47 Allowed Glycine 0 CA--C 1.525 0.713 0 C-N-CA 124.836 1.208 . . . . 0.0 111.954 169.668 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -91.55 156.77 17.43 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.592 0.757 . . . . 0.0 111.437 173.886 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.1 tt -152.99 133.05 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 124.453 1.101 . . . . 0.0 110.526 176.654 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 8.5 m -65.42 161.47 19.78 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.739 1.216 . . . . 0.0 113.464 -175.079 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -60.51 -21.78 62.85 Favored 'General case' 0 CA--C 1.547 0.827 0 N-CA-C 115.573 1.694 . . . . 0.0 115.573 -179.258 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -78.33 143.5 64.69 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 124.318 1.047 . . . . 0.0 112.702 -174.755 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -57.35 -25.6 66.41 Favored 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 123.556 2.837 . . . . 0.0 114.514 173.349 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -81.63 -0.79 44.08 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 125.058 1.343 . . . . 0.0 113.811 179.723 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.43 167.6 10.37 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.917 1.287 . . . . 0.0 114.164 -176.242 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -143.06 153.75 43.26 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 126.508 1.923 . . . . 0.0 108.811 179.717 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 99.1 mt -71.64 123.62 26.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 CA-C-O 121.583 0.706 . . . . 0.0 111.98 -174.793 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.92 99.13 11.91 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.801 1.64 . . . . 0.0 106.83 167.326 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -84.6 137.89 33.03 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.323 0.649 . . . . 0.0 111.187 -171.497 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 8.1 t -94.89 -175.43 3.56 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.537 1.135 . . . . 0.0 113.098 179.613 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 9.8 mp -60.94 149.7 35.64 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.347 1.859 . . . . 0.0 111.285 178.788 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -92.76 141.87 27.97 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.384 1.074 . . . . 0.0 109.808 172.155 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -147.26 164.16 34.08 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.755 1.222 . . . . 0.0 111.839 175.875 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -109.44 139.86 43.9 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.217 1.007 . . . . 0.0 112.671 -170.492 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 64.1 tp -108.48 132.15 54.1 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 125.915 1.686 . . . . 0.0 108.963 168.614 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 62.5 ttm-85 -123.83 115.92 22.11 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.754 1.622 . . . . 0.0 109.702 174.028 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 48.7 t -102.78 113.81 40.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 124.372 1.069 . . . . 0.0 108.75 172.006 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 65.0 p -93.65 146.83 23.54 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.605 1.562 . . . . 0.0 109.885 177.95 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -62.79 148.7 46.08 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 121.413 -0.804 . . . . 0.0 112.91 -175.782 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 45.8 ttt85 -78.36 119.32 21.54 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 124.047 0.939 . . . . 0.0 110.257 -173.943 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 66.6 ttp85 -71.05 138.85 50.16 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.559 0.744 . . . . 0.0 111.578 -175.439 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -81.42 149.42 28.82 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.599 1.16 . . . . 0.0 112.168 175.102 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 . . . . . 0 C--O 1.254 1.291 0 C-N-CA 125.698 1.599 . . . . 0.0 112.624 -177.211 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 2.1 tmt? . . . . . 0 N--CA 1.489 1.477 0 CA-C-O 118.468 -0.777 . . . . 0.0 110.238 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -81.81 133.87 8.21 Favored 'Trans proline' 0 CA--C 1.543 0.939 0 C-N-CA 123.439 2.759 . . . . 0.0 110.798 177.461 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -58.08 136.13 72.96 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 123.554 2.836 . . . . 0.0 113.124 173.228 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.8 p -137.14 156.82 47.88 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.134 1.373 . . . . 0.0 112.125 -172.603 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -146.33 120.22 9.33 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.912 1.685 . . . . 0.0 109.159 -178.159 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 80.5 p -140.97 159.37 62.25 Favored Pre-proline 0 CA--C 1.55 0.947 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -169.872 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -69.59 161.46 85.63 Favored 'Cis proline' 0 C--N 1.354 0.833 0 CA-C-N 119.551 0.875 . . . . 0.0 111.501 -6.434 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.48 -24.65 67.91 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 113.169 0.803 . . . . 0.0 113.169 176.052 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 46.7 tp -140.4 120.77 14.01 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.568 1.547 . . . . 0.0 108.761 169.854 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 55.4 tp -105.96 125.79 51.42 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.267 1.427 . . . . 0.0 109.029 170.635 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.4 t -110.27 124.39 66.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 124.082 0.953 . . . . 0.0 108.563 173.041 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.6 m -128.3 164.71 29.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 C-N-CA 124.644 1.178 . . . . 0.0 111.635 174.421 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 18.3 m -90.83 148.8 22.27 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.707 1.203 . . . . 0.0 110.437 173.962 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -53.18 123.68 12.45 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.823 1.249 . . . . 0.0 111.406 176.428 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 89.12 -1.56 82.92 Favored Glycine 0 CA--C 1.533 1.199 0 C-N-CA 125.869 1.7 . . . . 0.0 114.826 -177.298 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -86.72 156.68 19.86 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 119.597 1.698 . . . . 0.0 111.877 173.217 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -83.88 123.68 30.18 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.856 0.862 . . . . 0.0 110.294 175.682 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -101.48 129.15 47.48 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.478 1.111 . . . . 0.0 110.894 179.182 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 65.3 m -132.77 126.61 32.8 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.895 0.878 . . . . 0.0 111.533 -178.573 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -101.68 152.12 21.21 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.729 1.612 . . . . 0.0 110.812 169.747 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.6 m -100.72 126.77 47.29 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.639 1.576 . . . . 0.0 109.236 175.853 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 49.4 t -117.97 138.5 52.13 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.382 1.873 . . . . 0.0 111.124 177.561 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 74.1 m -137.55 126.93 24.82 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.528 -0.733 . . . . 0.0 110.17 176.054 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -120.63 156.16 32.26 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.707 1.603 . . . . 0.0 113.978 175.838 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.1 t -137.65 164.31 29.13 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.52 1.928 . . . . 0.0 107.853 166.85 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -156.87 157.1 34.28 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 -169.364 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 11.5 t -73.75 -32.69 63.96 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.082 1.353 . . . . 0.0 112.157 174.812 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 43.3 m -85.43 165.61 17.05 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.938 1.295 . . . . 0.0 111.912 174.485 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -71.56 -16.58 62.32 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.942 1.697 . . . . 0.0 114.287 -176.703 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 9.2 t -162.84 165.43 25.31 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.456 1.502 . . . . 0.0 111.248 178.529 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 46.1 p90 -158.32 155.5 28.91 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.453 1.501 . . . . 0.0 112.075 -173.723 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 93.8 t -95.9 125.36 48.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 125.119 1.368 . . . . 0.0 107.332 169.378 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 56.8 tp -99.95 136.94 39.11 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.978 0.911 . . . . 0.0 110.29 178.059 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 -127.25 160.29 31.74 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.397 1.479 . . . . 0.0 110.627 -176.58 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 19.0 t90 -126.38 139.79 53.0 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.075 1.35 . . . . 0.0 111.427 179.606 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -136.13 144.52 45.11 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.763 1.225 . . . . 0.0 113.749 -171.82 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 56.8 ttt85 -102.49 140.15 37.14 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.886 1.674 . . . . 0.0 107.789 167.162 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 35.4 mtp -89.64 145.94 24.89 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 118.98 0.809 . . . . 0.0 112.318 176.235 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.1 p -89.16 162.06 38.61 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 123.824 0.849 . . . . 0.0 111.991 172.141 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -67.79 -18.87 47.52 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 122.755 2.303 . . . . 0.0 112.642 172.413 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.6 m -80.8 3.99 20.58 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 124.744 1.218 . . . . 0.0 113.042 170.83 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 63.7 t30 70.97 26.38 3.6 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 127.329 2.252 . . . . 0.0 113.24 178.5 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -96.71 -172.7 2.54 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.408 1.083 . . . . 0.0 109.755 169.705 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.0 p -141.6 145.16 34.71 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.619 1.567 . . . . 0.0 110.698 -174.372 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -124.72 130.58 52.69 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 125.035 1.334 . . . . 0.0 110.776 175.821 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 37.5 tttm -83.77 119.1 24.4 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.61 1.164 . . . . 0.0 111.66 -173.134 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 57.5 mt -93.55 -49.19 6.01 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.559 1.544 . . . . 0.0 112.446 -169.278 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -166.5 176.38 7.39 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.289 1.836 . . . . 0.0 110.546 -173.798 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -158.48 163.47 37.1 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.721 1.209 . . . . 0.0 112.674 -175.142 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -137.62 122.72 12.49 Favored Pre-proline 0 CA--C 1.549 0.904 0 C-N-CA 125.569 1.548 . . . . 0.0 109.802 169.977 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -61.49 156.03 57.44 Favored 'Cis proline' 0 C--N 1.352 0.726 0 CA-C-N 120.056 1.056 . . . . 0.0 111.745 -4.251 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -61.69 109.43 1.21 Allowed 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.734 1.214 . . . . 0.0 113.327 -168.779 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -93.05 35.43 1.06 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.939 1.696 . . . . 0.0 111.517 175.268 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 40.6 ptt180 -60.05 -10.99 4.87 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.541 1.936 . . . . 0.0 115.406 -171.815 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 17.3 m -68.84 -10.06 54.8 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.445 1.498 . . . . 0.0 114.035 172.279 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -59.5 160.73 12.62 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 124.623 1.169 . . . . 0.0 112.99 173.602 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -72.59 159.5 48.71 Favored 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 122.658 2.239 . . . . 0.0 110.519 168.007 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 80.21 52.18 4.67 Favored Glycine 0 N--CA 1.47 0.958 0 C-N-CA 123.546 0.593 . . . . 0.0 111.854 179.506 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 83.7 mt-30 -83.03 57.47 3.93 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.341 1.456 . . . . 0.0 112.24 -170.19 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -81.39 118.61 22.82 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.677 1.191 . . . . 0.0 110.088 172.538 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 58.0 p -72.85 -9.19 58.4 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 -175.959 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 1.7 ptm85 -67.37 -20.6 65.59 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 -178.394 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -101.01 126.25 47.67 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.196 1.398 . . . . 0.0 110.267 179.065 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 79.3 mtm180 -134.25 149.81 50.98 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.705 1.202 . . . . 0.0 111.858 -178.24 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 46.6 t -126.5 130.98 71.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 125.112 1.365 . . . . 0.0 109.334 171.11 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 92.4 m -130.53 132.73 45.74 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.687 1.195 . . . . 0.0 110.233 -179.48 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -80.58 141.74 34.76 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.37 0.668 . . . . 0.0 111.824 173.548 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 26.4 mt -90.36 158.29 43.65 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 124.03 0.932 . . . . 0.0 111.342 173.604 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -66.73 -4.69 11.58 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 123.61 2.873 . . . . 0.0 113.97 174.814 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 23.7 m120 -64.31 -18.99 65.13 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.167 0.987 . . . . 0.0 113.428 172.439 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 95.18 -20.92 46.95 Favored Glycine 0 N--CA 1.474 1.205 0 C-N-CA 125.77 1.652 . . . . 0.0 115.392 169.715 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -154.5 73.53 0.91 Allowed 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.468 1.507 . . . . 0.0 109.914 171.288 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -170.39 136.97 1.39 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 127.707 2.403 . . . . 0.0 107.662 -171.99 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 70.8 m-85 -145.18 145.81 31.5 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.891 0.877 . . . . 0.0 112.916 -168.192 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -101.76 125.83 48.5 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.236 1.415 . . . . 0.0 111.433 169.998 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -104.91 112.96 26.28 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.819 2.048 . . . . 0.0 108.419 174.884 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 67.6 m -122.03 129.18 52.22 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 115.147 1.536 . . . . 0.0 115.147 -167.954 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 44.3 t -96.36 116.49 38.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 125.916 1.687 . . . . 0.0 107.532 168.288 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 85.7 t -78.63 125.84 38.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 124.158 0.983 . . . . 0.0 110.177 176.412 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 51.11 66.71 1.1 Allowed 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 126.218 1.807 . . . . 0.0 112.157 175.456 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.42 130.48 43.19 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.508 1.123 . . . . 0.0 111.572 -173.352 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.03 169.58 8.59 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.952 1.701 . . . . 0.0 110.274 171.706 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 27.7 mtp180 -56.29 -30.71 62.86 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 121.208 -0.932 . . . . 0.0 113.373 -177.098 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 29.7 t30 -60.43 -27.94 67.88 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 124.967 1.307 . . . . 0.0 114.387 172.299 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -75.62 -14.54 60.38 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.289 0.95 . . . . 0.0 113.086 175.536 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 34.2 m -61.63 141.34 57.86 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 120.231 1.378 . . . . 0.0 111.65 177.385 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 150.41 -169.67 30.34 Favored Glycine 0 N--CA 1.473 1.138 0 C-N-CA 124.377 0.989 . . . . 0.0 113.345 -176.997 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.3 m -94.88 142.45 27.45 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.271 1.028 . . . . 0.0 110.517 -178.057 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -138.82 162.51 34.58 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.137 1.775 . . . . 0.0 111.71 -179.144 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -161.75 157.56 24.46 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.578 1.551 . . . . 0.0 111.783 174.183 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 25.9 p -104.68 151.73 23.35 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.456 0.702 . . . . 0.0 111.754 168.834 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -148.47 133.05 4.41 Favored Glycine 0 N--CA 1.471 0.986 0 C-N-CA 124.709 1.147 . . . . 0.0 112.784 -177.836 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -110.57 156.02 21.51 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -176.175 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 19.7 tt -137.89 136.13 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 125.698 1.599 . . . . 0.0 109.921 174.026 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 14.4 t -62.77 157.52 20.97 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.774 0.83 . . . . 0.0 112.953 176.935 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.49 -9.65 50.31 Favored 'General case' 0 CA--C 1.546 0.827 0 N-CA-C 114.274 1.213 . . . . 0.0 114.274 169.95 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -68.56 149.18 98.07 Favored Pre-proline 0 CA--C 1.553 1.078 0 C-N-CA 124.341 1.056 . . . . 0.0 112.428 178.592 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -69.32 -26.13 29.93 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 122.951 2.434 . . . . 0.0 112.812 178.853 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.8 ptmt -86.04 5.22 34.51 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.218 1.407 . . . . 0.0 114.581 178.055 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.41 163.17 18.87 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.799 1.24 . . . . 0.0 114.214 -173.335 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.96 157.25 43.42 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 126.308 1.843 . . . . 0.0 108.648 176.875 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 61.7 mt -78.31 124.38 36.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 123.861 0.865 . . . . 0.0 111.269 -174.482 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 24.1 tptp -94.55 126.93 40.15 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.297 1.439 . . . . 0.0 109.613 168.839 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -84.38 157.02 21.57 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.293 1.037 . . . . 0.0 112.059 175.237 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 97.0 p -108.33 -166.13 1.1 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 125.241 1.416 . . . . 0.0 111.099 168.128 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 11.1 mp -63.16 151.02 41.41 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.347 1.059 . . . . 0.0 111.715 172.661 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -90.69 142.74 27.45 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.075 0.95 . . . . 0.0 109.985 171.542 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -135.0 152.93 52.18 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 125.322 1.449 . . . . 0.0 111.809 178.74 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -104.51 138.87 40.24 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.661 1.184 . . . . 0.0 111.687 -177.9 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 50.9 tp -108.81 129.28 55.39 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 125.905 1.682 . . . . 0.0 109.202 169.348 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 60.6 ttt85 -121.69 120.22 34.07 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.795 1.638 . . . . 0.0 109.71 173.664 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 39.1 t -104.22 118.91 52.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 124.177 0.991 . . . . 0.0 109.045 171.626 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 67.4 p -98.74 154.77 17.74 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 126.114 1.766 . . . . 0.0 110.459 178.266 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -65.85 144.78 56.61 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.674 -0.641 . . . . 0.0 112.21 -177.367 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 35.9 ttt85 -84.34 133.25 34.54 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.577 1.151 . . . . 0.0 109.862 179.169 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 -127.95 153.76 46.34 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.662 1.185 . . . . 0.0 111.669 -177.189 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -74.54 154.37 38.65 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.552 1.141 . . . . 0.0 112.363 174.415 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 . . . . . 0 C--O 1.253 1.258 0 C-N-CA 125.045 1.338 . . . . 0.0 113.277 176.131 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . 0.597 ' N ' ' HG ' ' A' ' 57' ' ' SER . 2.3 mpt? . . . . . 0 N--CA 1.488 1.446 0 CA-C-O 118.356 -0.83 . . . . 0.0 110.492 . . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -60.5 149.91 84.15 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 123.535 2.824 . . . . 0.0 112.096 173.229 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -71.13 115.49 4.29 Favored 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 123.743 2.962 . . . . 0.0 110.436 178.924 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.7 t -152.23 156.9 40.63 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.577 0.751 . . . . 0.0 112.802 -170.535 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 82.9 t80 -149.05 117.46 6.49 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.593 2.357 . . . . 0.0 108.647 -176.603 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 91.8 p -140.96 159.35 62.36 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 124.554 1.142 . . . . 0.0 113.558 -169.032 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -70.35 164.98 79.55 Favored 'Cis proline' 0 C--N 1.355 0.893 0 CA-C-N 119.987 1.031 . . . . 0.0 112.221 -2.535 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.05 -24.94 68.15 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 175.573 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 40.2 tp -143.55 119.03 10.32 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 125.772 1.629 . . . . 0.0 108.855 169.847 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 56.6 tp -102.1 124.39 47.63 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.656 1.182 . . . . 0.0 108.859 169.536 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.8 t -110.17 124.51 66.98 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 172.756 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 30.5 m -126.06 163.56 27.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 C-N-CA 124.388 1.075 . . . . 0.0 111.781 172.398 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 35.1 m -92.53 144.95 24.83 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.031 0.932 . . . . 0.0 109.863 171.836 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -49.65 124.59 9.86 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.333 1.453 . . . . 0.0 112.579 -179.262 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 91.52 -3.89 79.26 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 126.052 1.787 . . . . 0.0 114.818 -177.415 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -84.75 157.64 20.97 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.585 1.692 . . . . 0.0 112.088 174.929 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -83.61 117.65 23.3 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.84 0.856 . . . . 0.0 110.478 175.64 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -97.83 114.46 26.51 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.152 0.981 . . . . 0.0 111.134 -177.3 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 30.5 m -117.56 126.5 52.68 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.758 0.823 . . . . 0.0 111.793 -177.164 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -100.89 159.51 15.14 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.527 1.931 . . . . 0.0 109.969 169.385 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 93.3 m -102.36 139.16 38.33 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.346 1.458 . . . . 0.0 108.699 169.669 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 46.8 t -130.35 146.33 51.92 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.707 1.203 . . . . 0.0 111.234 171.062 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 16.0 t -149.54 133.62 17.18 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 121.347 -0.846 . . . . 0.0 111.342 179.044 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 18.5 m-85 -140.95 156.17 46.12 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 127.779 2.432 . . . . 0.0 111.69 -179.103 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.597 ' HG ' ' N ' ' A' ' 33' ' ' MET . 35.3 m -135.97 111.28 9.07 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.13 0.972 . . . . 0.0 110.54 168.44 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 52.8 m-80 -95.21 164.26 12.93 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.462 1.105 . . . . 0.0 111.014 172.545 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 19.9 m -65.01 -38.5 91.12 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.391 1.477 . . . . 0.0 111.423 177.968 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 33.5 m -71.28 147.01 48.57 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.857 1.263 . . . . 0.0 110.442 169.407 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -65.36 -32.4 74.02 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.47 1.108 . . . . 0.0 112.447 -178.353 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 66.7 m -123.8 158.58 31.46 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.41 1.484 . . . . 0.0 111.664 174.407 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 44.9 p90 -160.69 165.28 30.79 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.467 1.507 . . . . 0.0 111.437 -174.418 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 22.4 t -96.0 128.04 47.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 171.05 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 18.8 tp -105.12 139.11 40.28 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.911 0.884 . . . . 0.0 110.072 171.726 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 14.8 m-80 -132.94 150.38 52.16 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.582 1.553 . . . . 0.0 110.644 -169.698 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 9.4 t90 -121.71 137.55 54.71 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.201 1.0 . . . . 0.0 111.758 -178.493 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -134.07 144.32 48.56 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.565 1.146 . . . . 0.0 113.155 -175.434 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -104.89 140.08 38.68 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.028 1.331 . . . . 0.0 108.438 168.251 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 27.2 mtp -87.12 141.82 28.38 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 118.717 0.69 . . . . 0.0 111.956 178.879 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 50.2 m -92.81 157.98 38.64 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 124.888 1.275 . . . . 0.0 111.919 176.562 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_exo -55.73 -33.8 88.82 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 123.919 3.079 . . . . 0.0 114.113 176.48 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.7 m -77.03 9.55 2.91 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.182 1.393 . . . . 0.0 113.768 176.932 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 26.8 m120 70.42 20.9 5.85 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 127.336 2.254 . . . . 0.0 113.359 -179.016 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -89.99 -173.73 3.98 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.482 1.113 . . . . 0.0 110.549 170.555 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.9 p -144.15 145.93 32.43 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.779 1.632 . . . . 0.0 110.507 -175.635 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -123.15 132.4 54.06 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.648 1.179 . . . . 0.0 111.192 175.243 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -79.01 126.87 31.26 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.921 0.888 . . . . 0.0 111.382 -177.892 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 59.4 mt -99.75 -45.15 5.84 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.984 1.313 . . . . 0.0 112.472 -169.968 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -173.99 175.9 2.69 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.713 2.405 . . . . 0.0 110.282 -174.102 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -159.55 168.83 25.19 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.206 1.403 . . . . 0.0 112.379 -178.544 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -144.66 122.29 6.53 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 125.64 1.576 . . . . 0.0 110.042 169.481 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -51.59 145.72 10.07 Favored 'Cis proline' 0 C--N 1.352 0.759 0 CA-C-N 120.435 1.191 . . . . 0.0 112.582 -9.319 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -70.14 117.57 11.86 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 122.441 1.115 . . . . 0.0 113.696 -168.378 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -94.53 9.64 37.79 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.826 2.051 . . . . 0.0 112.284 177.938 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -56.88 -6.07 0.3 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 128.229 2.611 . . . . 0.0 117.012 -169.904 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 12.9 p -74.73 -20.45 59.83 Favored 'General case' 0 CA--C 1.546 0.822 0 O-C-N 120.987 -1.071 . . . . 0.0 112.897 169.078 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -84.41 144.79 43.89 Favored Pre-proline 0 CA--C 1.547 0.83 0 C-N-CA 124.576 1.15 . . . . 0.0 110.597 174.615 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -73.85 156.14 48.36 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 124.022 3.148 . . . . 0.0 113.853 -168.371 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 100.86 -24.88 30.37 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 126.337 1.923 . . . . 0.0 111.57 -178.115 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -82.57 148.22 28.16 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.936 1.294 . . . . 0.0 111.553 -178.707 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -143.0 142.38 31.59 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.588 1.155 . . . . 0.0 112.519 -174.677 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 15.4 m -65.72 -15.5 62.88 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 115.571 1.693 . . . . 0.0 115.571 -172.072 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 44.5 mtp-105 -65.97 -28.84 69.2 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.55 1.068 . . . . 0.0 112.14 171.884 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -92.03 127.88 37.67 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.922 1.289 . . . . 0.0 109.736 175.625 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -131.15 144.16 51.17 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.19 1.396 . . . . 0.0 110.804 -175.867 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 47.8 t -126.57 128.28 71.05 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 124.846 1.258 . . . . 0.0 108.986 176.478 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 88.5 m -125.98 132.31 52.07 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.82 1.248 . . . . 0.0 110.287 -176.939 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -88.13 137.94 31.88 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.024 0.929 . . . . 0.0 110.407 172.735 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 44.2 mt -87.47 158.7 51.31 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 124.745 1.218 . . . . 0.0 111.433 177.669 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -65.42 -2.71 6.46 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 123.529 2.819 . . . . 0.0 114.293 175.85 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -63.52 -26.08 68.54 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 119.643 1.11 . . . . 0.0 112.861 169.735 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 98.61 -22.22 42.05 Favored Glycine 0 N--CA 1.476 1.308 0 C-N-CA 125.696 1.617 . . . . 0.0 114.273 174.579 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -154.48 73.65 0.92 Allowed 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.519 1.528 . . . . 0.0 110.166 169.381 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 17.9 t0 -163.56 141.48 7.6 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 128.919 2.888 . . . . 0.0 106.819 178.486 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -146.42 155.75 42.8 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 -167.188 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 56.7 m170 -116.15 147.61 41.19 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 126.043 1.737 . . . . 0.0 110.955 168.502 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 33.3 mtt -132.94 112.96 12.3 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.622 1.569 . . . . 0.0 109.381 -178.009 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 68.0 m -118.41 126.21 51.59 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 -167.561 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 19.7 t -90.53 108.35 19.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 167.653 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 88.7 t -70.55 125.74 29.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 123.727 0.811 . . . . 0.0 109.389 176.325 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 39.2 ttm180 54.64 63.83 2.01 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.108 1.363 . . . . 0.0 111.035 172.241 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -70.38 137.36 50.44 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.554 0.742 . . . . 0.0 111.476 -171.427 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -114.66 163.44 15.44 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.818 1.647 . . . . 0.0 110.62 -179.542 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 88.1 mtm-85 -52.88 -34.96 57.08 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.867 0.867 . . . . 0.0 112.858 -175.501 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 39.5 t30 -66.13 -16.42 63.94 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.857 1.663 . . . . 0.0 115.238 176.216 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -80.28 -14.1 58.66 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 120.305 1.411 . . . . 0.0 112.989 176.312 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 20.2 m -62.74 138.79 58.6 Favored 'General case' 0 CA--C 1.546 0.806 0 O-C-N 121.015 -1.053 . . . . 0.0 112.706 -177.543 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 150.74 -163.87 29.77 Favored Glycine 0 N--CA 1.472 1.059 0 C-N-CA 124.505 1.05 . . . . 0.0 113.293 -177.762 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.8 m -92.53 138.89 31.12 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.484 1.114 . . . . 0.0 111.277 -177.213 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -134.24 160.43 37.89 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.43 1.892 . . . . 0.0 111.395 178.218 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -157.24 158.13 35.59 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.864 1.266 . . . . 0.0 112.64 173.096 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 45.5 t -109.41 147.61 32.51 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.865 1.666 . . . . 0.0 111.033 -178.68 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -150.66 142.13 9.32 Favored Glycine 0 N--CA 1.471 0.997 0 N-CA-C 114.63 0.612 . . . . 0.0 114.63 179.272 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -115.82 159.25 21.73 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.14 1.376 . . . . 0.0 113.684 -173.933 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 19.9 tt -155.95 136.36 4.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 125.723 1.609 . . . . 0.0 110.568 173.848 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 18.2 m -65.81 161.31 21.25 Favored 'General case' 0 N--CA 1.475 0.787 0 O-C-N 121.282 -0.886 . . . . 0.0 113.115 179.927 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 56.6 mt -70.06 -20.6 63.22 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.731 1.012 . . . . 0.0 113.731 -177.882 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -70.37 146.09 93.87 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 124.35 1.06 . . . . 0.0 112.253 177.4 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -69.65 -16.6 38.1 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 123.296 2.664 . . . . 0.0 113.273 -179.653 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 47.5 mmtm -79.95 -0.27 34.44 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.78 1.232 . . . . 0.0 114.142 177.114 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -77.05 165.22 24.91 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 125.633 1.573 . . . . 0.0 113.78 -178.093 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 27.4 mp0 -138.59 155.83 48.0 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.902 1.681 . . . . 0.0 109.719 174.262 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 32.0 mm -60.48 137.11 23.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 124.421 1.088 . . . . 0.0 111.158 177.879 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.12 137.2 54.91 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.983 1.713 . . . . 0.0 109.54 169.585 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -113.94 153.7 28.83 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.27 1.028 . . . . 0.0 112.863 -169.424 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 80.2 p -104.44 173.31 6.36 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.655 1.582 . . . . 0.0 112.914 174.717 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.83 122.81 18.51 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.532 1.133 . . . . 0.0 110.88 174.416 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.73 151.26 45.59 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.14 0.976 . . . . 0.0 113.227 179.662 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -143.0 164.81 29.06 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.52 1.528 . . . . 0.0 112.913 -178.486 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -102.78 143.13 32.81 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.267 1.427 . . . . 0.0 112.834 -172.737 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 60.7 tp -114.79 132.13 56.57 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 126.343 1.857 . . . . 0.0 108.542 168.075 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 61.9 ttm-85 -126.01 120.22 29.72 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.284 1.433 . . . . 0.0 109.908 174.098 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 41.2 t -104.36 113.09 40.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 124.355 1.062 . . . . 0.0 108.623 170.507 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 71.2 p -93.01 145.31 24.47 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.342 1.457 . . . . 0.0 109.858 178.925 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -66.64 144.91 56.11 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 121.431 0.634 . . . . 0.0 111.959 -178.212 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 55.8 ttm-85 -84.68 121.44 27.67 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 123.878 0.871 . . . . 0.0 110.337 -176.622 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -72.27 161.67 30.53 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.054 0.942 . . . . 0.0 113.402 -178.714 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -74.95 154.41 38.14 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.421 1.088 . . . . 0.0 110.5 167.788 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 . . . . . 0 N--CA 1.483 1.207 0 C-N-CA 126.845 2.058 . . . . 0.0 115.561 177.869 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 25.2 ptp . . . . . 0 N--CA 1.489 1.479 0 CA-C-O 118.404 -0.807 . . . . 0.0 111.151 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -75.59 158.9 39.68 Favored 'Trans proline' 0 CA--C 1.542 0.92 0 C-N-CA 123.343 2.695 . . . . 0.0 111.115 174.356 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -67.96 114.95 3.55 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 123.558 2.839 . . . . 0.0 109.684 174.586 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 27.5 m -134.65 147.96 50.26 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 126.993 2.117 . . . . 0.0 109.117 -172.312 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 43.9 t80 -149.01 121.39 8.45 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.677 1.191 . . . . 0.0 110.484 -176.576 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 58.7 m -140.87 159.89 60.53 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 124.489 1.115 . . . . 0.0 113.026 -169.344 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -70.02 158.85 91.37 Favored 'Cis proline' 0 C--N 1.353 0.807 0 CA-C-N 119.88 0.993 . . . . 0.0 111.482 -5.168 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.56 -30.99 69.02 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 174.476 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 33.4 tp -134.93 123.08 22.83 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 125.44 1.496 . . . . 0.0 108.932 170.403 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 54.7 tp -108.37 124.84 50.99 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.736 1.214 . . . . 0.0 109.256 170.524 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 18.8 t -109.76 124.31 66.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 C-N-CA 123.935 0.894 . . . . 0.0 108.898 173.566 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.6 m -127.64 169.83 18.43 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 C-N-CA 124.897 1.279 . . . . 0.0 111.355 171.924 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 89.5 m -100.0 147.86 25.15 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.771 1.229 . . . . 0.0 110.244 174.757 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -55.32 119.1 5.06 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.676 1.19 . . . . 0.0 112.159 179.808 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.87 -1.16 63.16 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 126.301 1.905 . . . . 0.0 114.709 -176.911 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -90.93 153.73 19.98 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 119.275 1.538 . . . . 0.0 110.924 171.245 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -80.79 139.91 35.77 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 121.875 0.845 . . . . 0.0 111.519 171.919 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -114.65 130.27 56.78 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.246 1.818 . . . . 0.0 110.545 -178.664 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 30.9 m -132.7 124.6 28.49 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.71 0.804 . . . . 0.0 111.618 -176.552 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -101.59 159.57 15.19 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.032 1.733 . . . . 0.0 110.299 169.469 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 25.9 m -112.66 132.02 55.37 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.368 1.467 . . . . 0.0 110.067 175.057 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 35.3 t -114.39 140.82 48.36 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.572 1.549 . . . . 0.0 112.08 171.899 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 17.2 m -134.13 131.85 39.19 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.967 1.707 . . . . 0.0 108.305 176.036 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 42.4 p90 -160.69 156.18 25.07 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 119.919 1.236 . . . . 0.0 113.558 -169.179 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.5 p -83.45 147.69 27.69 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.746 1.218 . . . . 0.0 113.109 173.876 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -163.73 160.32 22.44 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.159 2.184 . . . . 0.0 110.262 174.418 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 80.6 p -68.27 175.25 3.39 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 124.115 0.966 . . . . 0.0 112.932 -173.505 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 20.2 m -70.94 -8.23 51.58 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 172.861 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -93.5 -79.24 0.41 Allowed 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.74 1.216 . . . . 0.0 111.672 -176.015 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.5 t -173.28 167.16 4.82 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.164 1.386 . . . . 0.0 111.396 -169.876 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 55.9 p90 -160.56 163.0 33.07 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.05 1.34 . . . . 0.0 113.501 -170.156 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 62.4 t -107.14 124.2 62.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 125.5 1.52 . . . . 0.0 107.08 167.681 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -99.4 140.78 33.07 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.454 1.502 . . . . 0.0 108.014 170.701 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 31.4 m120 -136.68 149.42 47.91 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.502 1.521 . . . . 0.0 111.171 175.331 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 22.0 t90 -124.55 138.36 54.33 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.525 1.13 . . . . 0.0 110.73 174.602 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -132.47 147.94 52.38 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 -170.939 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.9 ttt180 -109.26 141.34 41.69 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.792 1.637 . . . . 0.0 108.355 167.242 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 36.2 mtp -86.42 145.89 26.66 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 118.944 0.793 . . . . 0.0 112.462 176.301 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.1 p -88.88 165.2 28.34 Favored Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 123.89 0.876 . . . . 0.0 112.662 174.162 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -58.82 -28.98 88.65 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 123.636 2.891 . . . . 0.0 113.433 170.594 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.4 m -80.36 1.78 27.49 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.896 1.279 . . . . 0.0 113.265 175.939 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 73.61 21.09 2.92 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 127.588 2.355 . . . . 0.0 113.213 -179.649 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -88.38 -172.67 3.87 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.622 0.769 . . . . 0.0 109.575 169.483 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 3.3 p -140.59 142.86 35.04 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.376 1.47 . . . . 0.0 110.804 -174.84 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -122.86 131.53 53.79 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.505 1.122 . . . . 0.0 110.922 175.442 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 20.8 ttmt -71.9 137.74 47.65 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.873 0.869 . . . . 0.0 110.632 178.385 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 52.8 mt -114.61 -45.99 2.98 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.936 1.695 . . . . 0.0 111.975 -171.944 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -156.51 168.62 26.82 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 126.281 1.832 . . . . 0.0 109.689 179.683 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -156.62 163.68 39.05 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.348 1.059 . . . . 0.0 111.955 -174.801 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -149.2 110.35 3.46 Favored Pre-proline 0 CA--C 1.547 0.835 0 CA-C-O 118.024 -0.988 . . . . 0.0 110.676 174.646 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -51.64 143.82 9.4 Favored 'Cis proline' 0 C--N 1.352 0.734 0 CA-C-N 120.64 1.264 . . . . 0.0 113.623 -4.794 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -75.73 135.1 40.35 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.386 1.075 . . . . 0.0 113.754 -169.239 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 37.2 t0 -104.68 36.29 2.47 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 126.297 1.839 . . . . 0.0 112.374 -168.551 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 45.3 mmm-85 -61.83 -21.95 65.07 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 125.314 1.446 . . . . 0.0 114.74 -170.226 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 16.4 p -78.75 -14.33 59.34 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 113.688 0.996 . . . . 0.0 113.688 177.545 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -98.53 155.36 36.89 Favored Pre-proline 0 CA--C 1.545 0.786 0 C-N-CA 125.036 1.334 . . . . 0.0 110.672 174.531 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -72.55 149.51 49.7 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 123.382 2.721 . . . . 0.0 111.872 -176.337 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 102.41 -21.01 42.62 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 125.643 1.592 . . . . 0.0 112.274 -177.665 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -87.14 73.75 9.73 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 122.312 1.053 . . . . 0.0 111.524 -179.374 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -83.83 145.75 28.49 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.82 1.648 . . . . 0.0 111.789 174.865 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 40.7 m -67.07 -12.87 61.15 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 -171.925 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 44.6 mtp180 -66.54 -27.03 67.43 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.18 0.9 . . . . 0.0 112.627 171.042 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 -95.01 137.48 34.0 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.937 1.295 . . . . 0.0 111.079 178.43 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 30.0 ttp180 -144.46 151.61 39.43 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.234 1.014 . . . . 0.0 111.925 177.421 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -122.79 133.83 67.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 124.962 1.305 . . . . 0.0 110.753 168.869 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.1 m -130.5 130.01 43.63 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.098 1.359 . . . . 0.0 109.871 -173.247 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -79.4 136.38 36.95 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 118.736 0.698 . . . . 0.0 110.778 178.549 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 7.0 mt -79.79 159.9 70.39 Favored Pre-proline 0 CA--C 1.544 0.715 0 CA-C-O 118.92 -0.562 . . . . 0.0 111.652 177.773 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -62.85 -16.74 55.65 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 123.135 2.556 . . . . 0.0 113.646 170.996 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -66.11 -26.06 67.28 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 119.231 0.923 . . . . 0.0 112.439 169.793 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 86.21 -34.11 3.49 Favored Glycine 0 N--CA 1.472 1.066 0 C-N-CA 126.836 2.16 . . . . 0.0 114.393 169.881 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 -111.53 73.65 0.83 Allowed 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.594 1.158 . . . . 0.0 108.194 169.41 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 175.36 141.3 0.05 Allowed 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 128.388 2.675 . . . . 0.0 109.739 -170.606 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -142.33 150.22 40.48 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.453 1.101 . . . . 0.0 112.37 178.931 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 18.2 m170 -98.82 139.24 34.79 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.329 1.452 . . . . 0.0 110.229 167.003 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -115.11 113.07 23.52 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 126.761 2.024 . . . . 0.0 108.058 175.961 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 17.8 m -118.76 128.44 54.49 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 114.331 1.234 . . . . 0.0 114.331 -167.338 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 36.6 t -99.24 117.56 44.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 125.869 1.668 . . . . 0.0 106.947 167.528 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 97.2 t -83.09 126.33 40.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 123.893 0.877 . . . . 0.0 109.96 174.577 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 85.5 mtt85 54.21 66.55 1.2 Allowed 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 126.11 1.764 . . . . 0.0 111.624 176.963 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.96 136.43 53.92 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.487 1.115 . . . . 0.0 111.308 -176.87 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -118.26 165.64 13.57 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 126.9 2.08 . . . . 0.0 110.462 -178.262 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 26.3 mmm180 -52.52 -28.73 21.83 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.348 1.059 . . . . 0.0 113.054 178.231 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -63.66 -24.22 67.7 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 125.66 1.584 . . . . 0.0 114.825 173.228 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -86.08 -17.88 33.9 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 120.147 1.34 . . . . 0.0 113.682 -176.992 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 49.3 m -57.71 133.86 55.72 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 120.779 -1.2 . . . . 0.0 112.681 -178.742 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 153.39 -167.46 31.91 Favored Glycine 0 N--CA 1.473 1.152 0 C-N-CA 124.253 0.93 . . . . 0.0 113.788 -176.073 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.2 m -91.1 143.05 27.1 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 125.162 1.385 . . . . 0.0 110.825 -175.861 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -139.94 157.55 45.5 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 126.462 1.905 . . . . 0.0 111.551 -177.796 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -156.94 149.31 23.18 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.324 1.05 . . . . 0.0 113.269 173.011 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 44.3 t -89.63 152.98 21.1 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.35 1.86 . . . . 0.0 110.884 172.057 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -160.05 141.63 7.6 Favored Glycine 0 N--CA 1.47 0.936 0 O-C-N 121.469 -0.769 . . . . 0.0 113.207 170.214 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -138.13 158.59 44.01 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 118.259 1.029 . . . . 0.0 113.154 -177.419 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 16.7 tt -147.27 134.62 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 C-N-CA 125.364 1.466 . . . . 0.0 110.097 -178.951 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 65.7 m -76.17 158.48 31.65 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 121.62 -0.675 . . . . 0.0 111.795 176.994 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 28.3 mt -73.92 -10.01 59.22 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 -177.264 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.81 143.06 94.53 Favored Pre-proline 0 CA--C 1.551 1.012 0 C-N-CA 124.104 0.962 . . . . 0.0 111.816 173.738 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -67.72 -19.83 47.05 Favored 'Trans proline' 0 CA--C 1.538 0.675 0 C-N-CA 123.313 2.676 . . . . 0.0 113.35 -176.943 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 23.3 ttpp -83.7 -0.39 50.56 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 124.92 1.288 . . . . 0.0 113.572 177.459 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -74.87 149.75 39.43 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.364 1.066 . . . . 0.0 113.39 -178.277 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -128.89 158.29 39.19 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.925 2.09 . . . . 0.0 107.764 169.991 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 35.1 mt -70.94 114.9 9.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 O-C-N 121.487 -0.758 . . . . 0.0 110.43 -179.072 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -77.85 88.51 4.06 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.32 1.448 . . . . 0.0 108.792 169.629 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -78.65 133.71 37.21 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.129 0.972 . . . . 0.0 110.394 176.898 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 45.0 m -83.68 175.53 9.64 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.396 1.078 . . . . 0.0 113.225 179.669 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 84.5 mt -58.56 147.49 32.03 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.188 0.995 . . . . 0.0 111.563 171.682 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -75.51 132.29 40.65 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 123.369 0.668 . . . . 0.0 110.561 173.839 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.9 169.65 9.07 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 126.268 1.827 . . . . 0.0 109.877 170.06 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -133.98 145.09 49.19 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 122.027 0.917 . . . . 0.0 113.021 173.271 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 68.0 tp -103.66 135.11 45.85 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 127.081 2.152 . . . . 0.0 109.687 176.233 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 60.7 ttt85 -125.27 118.09 25.22 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.731 1.612 . . . . 0.0 109.858 172.425 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 53.2 t -98.4 118.81 45.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 C-N-CA 124.062 0.945 . . . . 0.0 108.573 169.057 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 81.7 p -91.53 149.81 21.5 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.411 1.485 . . . . 0.0 109.999 173.438 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -63.16 147.09 51.87 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.276 0.56 . . . . 0.0 112.035 -179.028 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 27.5 ttm180 -70.39 121.33 17.5 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 123.805 0.842 . . . . 0.0 109.93 -176.072 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 67.2 mtt85 -80.64 154.58 27.29 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.065 0.946 . . . . 0.0 112.401 -169.322 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -73.4 154.34 40.06 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.579 1.152 . . . . 0.0 112.508 175.406 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 . . . . . 0 N--CA 1.486 1.367 0 C-N-CA 129.463 3.105 . . . . 0.0 113.236 177.352 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . 0.491 ' N ' ' HG ' ' A' ' 57' ' ' SER . 24.2 ptt? . . . . . 0 N--CA 1.49 1.551 0 CA-C-O 118.53 -0.748 . . . . 0.0 111.467 . . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_exo -59.29 146.24 95.34 Favored 'Trans proline' 0 CA--C 1.541 0.856 0 C-N-CA 123.161 2.574 . . . . 0.0 111.853 172.096 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -74.68 145.74 33.17 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 123.035 2.49 . . . . 0.0 110.991 176.319 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 32.1 p -154.62 144.93 22.03 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 125.681 1.592 . . . . 0.0 110.994 -179.945 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.408 ' CE1' ' HB2' ' A' ' 123' ' ' CYS . 3.9 m-85 -121.86 135.67 54.9 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.004 1.322 . . . . 0.0 110.557 175.328 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 95.1 p -140.98 159.04 63.48 Favored Pre-proline 0 CA--C 1.549 0.921 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 173.31 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -72.7 163.72 88.0 Favored 'Cis proline' 0 C--N 1.352 0.737 0 CA-C-N 119.186 0.745 . . . . 0.0 111.411 -11.376 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.7 -33.9 74.82 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 170.432 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 51.7 tp -138.93 123.57 18.53 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.594 1.557 . . . . 0.0 109.269 171.563 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 51.6 tp -105.14 130.78 53.23 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.259 1.424 . . . . 0.0 109.341 170.755 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.4 t -112.06 126.55 69.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.987 0.915 . . . . 0.0 108.658 170.607 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.3 m -129.56 165.98 28.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 124.545 1.138 . . . . 0.0 111.933 173.079 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 20.0 m -86.3 146.5 26.48 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.178 0.991 . . . . 0.0 110.138 169.573 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 58.1 tt0 -55.32 123.59 14.3 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.042 1.337 . . . . 0.0 110.799 173.02 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.0 -0.5 72.77 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 125.5 1.524 . . . . 0.0 114.861 -174.334 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -95.43 158.08 15.61 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 119.644 1.722 . . . . 0.0 112.274 174.522 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 -83.11 116.58 22.39 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.073 0.949 . . . . 0.0 110.747 -179.866 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -98.47 116.12 30.01 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.292 1.037 . . . . 0.0 111.147 -179.793 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 57.1 m -125.28 125.45 43.55 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 118.718 0.69 . . . . 0.0 111.896 -174.609 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -101.06 146.72 27.07 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 126.371 1.868 . . . . 0.0 110.689 171.989 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 31.5 m -93.95 129.34 40.45 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.042 1.337 . . . . 0.0 108.813 171.199 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 69.8 m -130.3 130.24 44.25 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.398 1.079 . . . . 0.0 110.654 172.252 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 68.5 m -117.44 143.4 46.05 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.339 1.456 . . . . 0.0 110.687 -176.316 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -149.59 156.22 41.57 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.248 1.419 . . . . 0.0 113.475 -172.841 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.491 ' HG ' ' N ' ' A' ' 33' ' ' MET . 18.6 m -143.57 133.97 24.71 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.291 1.436 . . . . 0.0 109.834 167.734 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -143.96 166.1 25.89 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.017 1.327 . . . . 0.0 112.324 -177.428 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 25.0 p -73.1 169.62 16.63 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 127.004 2.122 . . . . 0.0 112.219 177.525 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 49.3 m 66.96 10.59 7.78 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 125.565 1.546 . . . . 0.0 114.908 169.242 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 70.29 -0.76 2.71 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 127.725 2.41 . . . . 0.0 114.041 175.621 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 22.8 t -161.17 150.29 16.52 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.592 1.557 . . . . 0.0 111.247 -175.606 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 50.3 p90 -160.17 163.01 34.0 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.505 1.522 . . . . 0.0 111.461 -169.324 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 77.4 t -95.93 127.98 47.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 172.263 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 61.3 tp -106.54 136.16 46.79 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 125.217 1.407 . . . . 0.0 109.751 173.618 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -132.43 153.8 50.48 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.282 1.833 . . . . 0.0 110.528 179.151 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 15.0 t90 -123.52 139.82 53.63 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.659 1.184 . . . . 0.0 111.118 176.081 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 64.4 m-85 -134.28 143.7 47.91 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 114.516 1.302 . . . . 0.0 114.516 -170.824 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 56.9 ttt85 -102.19 143.01 32.53 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.575 1.55 . . . . 0.0 109.229 168.406 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 86.3 mmm -77.46 133.04 38.71 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 118.466 0.575 . . . . 0.0 111.463 174.319 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.5 p -82.45 166.22 37.73 Favored Pre-proline 0 CA--C 1.549 0.914 0 O-C-N 121.557 -0.715 . . . . 0.0 112.555 173.669 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -58.32 -27.99 83.08 Favored 'Trans proline' 0 C--N 1.354 0.856 0 C-N-CA 123.475 2.784 . . . . 0.0 113.662 170.267 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 31.3 m -83.92 2.94 36.21 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.985 1.314 . . . . 0.0 113.189 175.424 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 69.55 26.68 5.02 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 126.721 2.008 . . . . 0.0 112.639 -178.758 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -92.23 -177.47 4.67 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.083 0.953 . . . . 0.0 109.743 169.606 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 8.7 p -127.48 122.51 33.64 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.574 1.55 . . . . 0.0 109.582 -171.981 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -108.22 126.35 52.7 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 124.288 1.035 . . . . 0.0 110.976 -178.094 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -79.22 120.53 23.84 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.632 1.173 . . . . 0.0 111.98 -170.809 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 42.4 mt -97.88 -49.38 4.82 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.654 1.582 . . . . 0.0 111.991 -170.139 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -162.56 169.17 20.68 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.438 1.895 . . . . 0.0 110.145 -173.12 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -157.22 162.65 39.27 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.451 1.101 . . . . 0.0 112.928 -170.155 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -152.32 113.5 2.85 Favored Pre-proline 0 CA--C 1.552 1.038 0 C-N-CA 125.379 1.472 . . . . 0.0 111.114 174.547 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -63.04 160.96 57.85 Favored 'Cis proline' 0 CA--C 1.538 0.686 0 CA-C-N 119.653 0.912 . . . . 0.0 110.287 -12.041 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -74.57 94.6 2.67 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.833 0.825 . . . . 0.0 111.419 -178.233 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -88.91 -0.85 57.75 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.927 1.691 . . . . 0.0 113.773 -179.251 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 50.1 ptt85 -64.09 -35.22 80.04 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.958 1.703 . . . . 0.0 114.217 -173.424 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.0 m 66.44 -45.12 0.43 Allowed 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 128.342 2.657 . . . . 0.0 114.671 -177.048 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 26.0 tp60 -90.0 140.9 27.65 Favored Pre-proline 0 CA--C 1.548 0.873 0 C-N-CA 126.061 1.744 . . . . 0.0 111.085 -176.548 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -89.21 -179.47 2.05 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 124.986 3.791 . . . . 0.0 112.023 175.047 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 112.72 -0.19 26.0 Favored Glycine 0 N--CA 1.471 1.022 0 C-N-CA 125.022 1.296 . . . . 0.0 114.331 173.534 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 22.3 mp0 -76.21 156.67 33.39 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.551 1.14 . . . . 0.0 111.286 175.748 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -68.1 126.81 30.7 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.281 1.032 . . . . 0.0 111.851 178.335 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 16.1 m -68.95 -12.76 61.95 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 -172.877 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 60.6 mtm-85 -65.26 -44.49 87.9 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.649 1.18 . . . . 0.0 112.574 -179.427 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 84.4 m-85 -69.48 130.68 43.16 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.473 1.509 . . . . 0.0 112.026 -179.045 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 31.8 ttp-105 -144.39 141.29 29.57 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 126.041 1.737 . . . . 0.0 111.079 -176.841 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 57.9 t -108.46 127.81 64.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 C-N-CA 125.089 1.356 . . . . 0.0 108.678 169.502 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 6.0 m -123.32 138.65 54.57 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.633 1.573 . . . . 0.0 109.428 -176.323 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.16 141.79 34.44 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.108 0.963 . . . . 0.0 112.679 179.373 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.449 HD23 ' HA ' ' A' ' 106' ' ' PHE . 0.9 OUTLIER -96.76 158.72 33.08 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 126.079 1.752 . . . . 0.0 111.169 -174.75 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -66.98 -11.28 31.64 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 123.627 2.884 . . . . 0.0 114.224 -178.993 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -66.56 -18.25 65.26 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 119.197 0.908 . . . . 0.0 113.248 172.203 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 88.83 -14.69 59.57 Favored Glycine 0 CA--C 1.535 1.3 0 C-N-CA 125.496 1.522 . . . . 0.0 115.323 175.492 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.4 ptp180 -154.51 73.53 0.91 Allowed 'General case' 0 N--CA 1.473 0.694 0 CA-C-O 122.972 1.367 . . . . 0.0 110.581 171.585 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -165.04 143.87 6.59 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 129.254 3.022 . . . . 0.0 106.684 -179.657 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . 0.449 ' HA ' HD23 ' A' ' 100' ' ' LEU . 52.0 m-85 -145.32 145.2 31.13 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -167.54 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 7.3 m-70 -109.1 117.6 34.58 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.539 1.536 . . . . 0.0 110.859 170.118 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -100.47 111.16 23.38 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 125.768 1.627 . . . . 0.0 108.206 177.855 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 13.6 t -120.12 130.09 54.46 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 -168.061 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 12.1 t -97.45 100.25 10.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 125.696 1.598 . . . . 0.0 107.045 168.444 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 95.4 t -66.83 130.8 32.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 123.662 0.785 . . . . 0.0 109.907 178.191 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . 0.265 14.6 ptm180 39.7 61.16 1.48 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 127.516 2.326 . . . . 0.0 113.94 -177.123 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.76 140.01 57.71 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.403 1.481 . . . . 0.0 112.605 -171.731 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -104.61 162.02 13.63 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.355 1.462 . . . . 0.0 110.866 -179.478 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 16.4 mmm180 -47.48 -41.12 20.0 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.471 1.108 . . . . 0.0 113.015 178.043 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -65.27 -21.56 66.74 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 125.349 1.46 . . . . 0.0 114.832 177.657 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -75.8 -12.24 60.13 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 119.133 0.879 . . . . 0.0 112.532 176.993 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.5 m -59.09 139.53 56.78 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 120.634 -1.291 . . . . 0.0 111.609 171.794 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 154.76 -168.28 32.79 Favored Glycine 0 N--CA 1.468 0.771 0 C-N-CA 123.927 0.775 . . . . 0.0 113.313 179.428 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.1 m -95.5 144.23 26.16 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.934 1.294 . . . . 0.0 110.191 -179.115 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 -142.82 162.95 34.11 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.605 1.562 . . . . 0.0 112.488 -175.143 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.1 pp -153.48 148.39 26.57 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.845 1.258 . . . . 0.0 111.984 169.154 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . 0.408 ' HB2' ' CE1' ' A' ' 37' ' ' PHE . 71.0 m -90.24 153.1 20.74 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.701 1.2 . . . . 0.0 109.652 169.383 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -152.95 134.1 4.31 Favored Glycine 0 N--CA 1.471 1.026 0 O-C-N 121.225 -0.922 . . . . 0.0 113.373 176.45 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -119.75 157.57 28.32 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.347 1.059 . . . . 0.0 112.417 -178.856 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 20.0 tt -151.41 132.17 4.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 124.868 1.267 . . . . 0.0 110.77 177.939 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 44.9 t -65.21 157.82 27.81 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.894 0.877 . . . . 0.0 112.819 178.251 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 3.8 pp -71.51 -9.48 58.27 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 175.024 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -66.5 146.09 99.02 Favored Pre-proline 0 CA--C 1.552 1.023 0 C-N-CA 124.318 1.047 . . . . 0.0 112.057 175.948 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -68.75 -24.6 34.49 Favored 'Trans proline' 0 CA--C 1.539 0.736 0 C-N-CA 123.092 2.528 . . . . 0.0 113.023 -178.746 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.6 ptmt -83.16 1.37 40.87 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 177.827 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.04 163.75 21.66 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.525 1.13 . . . . 0.0 113.751 -174.837 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 22.3 pt20 -149.68 163.07 38.94 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.53 1.932 . . . . 0.0 109.31 175.32 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 67.1 mt -73.13 119.27 19.74 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 CA-C-O 121.799 0.809 . . . . 0.0 111.174 -173.65 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 25.2 ttmt -88.08 124.73 34.07 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 126.857 2.063 . . . . 0.0 109.536 169.688 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -147.72 158.72 44.15 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.266 1.426 . . . . 0.0 111.292 -179.036 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 17.9 m -117.46 -173.54 2.44 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.674 1.59 . . . . 0.0 111.913 179.855 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 98.5 mt -60.02 143.25 52.33 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.125 0.97 . . . . 0.0 111.836 176.533 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 91.8 mtm-85 -66.52 153.35 43.17 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.91 1.284 . . . . 0.0 113.388 -172.619 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -115.89 162.56 17.15 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.567 1.947 . . . . 0.0 110.811 175.675 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -130.16 142.74 50.56 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.604 1.162 . . . . 0.0 111.618 -177.2 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 50.9 tp -116.09 133.89 55.54 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 125.978 1.711 . . . . 0.0 110.082 173.41 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 43.5 ttm180 -122.36 117.17 25.41 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.881 1.673 . . . . 0.0 109.31 170.427 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 54.4 t -99.99 119.21 47.74 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 N-CA-C 107.861 -1.162 . . . . 0.0 107.861 169.962 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 72.6 p -98.68 139.9 33.7 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.31 1.444 . . . . 0.0 109.422 177.614 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 4.5 pm0 -62.98 146.04 54.02 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.672 0.789 . . . . 0.0 113.119 -173.041 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 42.9 ttt85 -77.68 117.11 18.77 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 124.132 0.973 . . . . 0.0 110.338 -170.179 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 65.6 ttp85 -72.21 140.33 48.66 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.492 0.717 . . . . 0.0 111.671 -174.619 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -75.22 154.27 37.66 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.644 1.177 . . . . 0.0 112.715 176.253 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 . . . . . 0 C--O 1.254 1.334 0 N-CA-C 114.533 1.309 . . . . 0.0 114.533 177.21 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 27.1 ttt . . . . . 0 N--CA 1.488 1.461 0 CA-C-O 118.358 -0.829 . . . . 0.0 110.391 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_exo -60.3 165.59 10.68 Favored 'Trans proline' 0 CA--C 1.544 1.002 0 C-N-CA 124.025 3.15 . . . . 0.0 113.255 172.41 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -54.29 148.64 40.5 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 123.97 3.113 . . . . 0.0 113.892 174.151 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.8 t -162.5 160.53 26.25 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.052 0.941 . . . . 0.0 112.704 -172.502 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -146.82 118.0 7.81 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.642 1.977 . . . . 0.0 110.007 179.332 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 90.2 p -140.91 163.23 43.92 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 125.027 1.331 . . . . 0.0 113.5 -171.114 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -70.87 165.5 79.6 Favored 'Cis proline' 0 C--N 1.353 0.803 0 CA-C-N 119.932 1.011 . . . . 0.0 111.818 -7.945 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.64 -29.52 70.74 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 172.785 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 51.8 tp -141.31 124.63 16.55 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.65 1.58 . . . . 0.0 109.205 172.356 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 61.3 tp -109.53 126.02 53.12 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.489 1.516 . . . . 0.0 109.012 170.685 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.2 t -110.25 125.14 67.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 123.921 0.888 . . . . 0.0 108.784 173.359 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 33.5 m -130.39 162.8 37.62 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.075 0 C-N-CA 124.667 1.187 . . . . 0.0 112.091 174.053 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 16.5 m -88.36 147.48 24.73 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.533 1.133 . . . . 0.0 110.478 171.874 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -58.61 121.56 11.3 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.884 0.874 . . . . 0.0 112.117 -179.514 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 98.98 -2.94 58.34 Favored Glycine 0 CA--C 1.533 1.162 0 C-N-CA 125.844 1.688 . . . . 0.0 114.54 -173.903 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -87.65 158.16 18.92 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 119.743 1.772 . . . . 0.0 112.443 177.314 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -77.48 116.04 17.74 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.429 1.092 . . . . 0.0 110.492 170.633 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -102.63 119.62 39.14 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.993 0.917 . . . . 0.0 110.439 178.528 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 54.1 m -128.84 125.37 37.56 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 119.052 0.842 . . . . 0.0 111.711 -175.996 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -98.09 155.69 17.01 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.068 1.747 . . . . 0.0 110.253 169.826 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 56.5 m -107.97 125.7 51.83 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.094 1.358 . . . . 0.0 109.476 177.344 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 16.6 t -118.37 151.64 37.36 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.825 1.25 . . . . 0.0 111.265 170.458 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 24.8 t -147.94 133.28 18.53 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.161 -0.962 . . . . 0.0 111.76 174.186 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 33.2 m-85 -138.42 156.11 47.87 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 127.699 2.399 . . . . 0.0 110.083 170.369 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.3 t -141.25 138.17 33.06 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.429 1.092 . . . . 0.0 110.13 170.58 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 57.4 m-80 -141.13 167.6 21.8 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.571 1.548 . . . . 0.0 110.681 -178.337 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 10.9 t -151.7 167.46 28.11 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.325 1.45 . . . . 0.0 111.318 -179.034 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 55.5 m 69.36 -30.95 0.2 Allowed 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 128.77 2.828 . . . . 0.0 114.173 -174.295 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -143.68 145.5 32.5 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 127.571 2.348 . . . . 0.0 108.319 175.297 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 70.5 m -77.7 169.11 18.86 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.192 0.997 . . . . 0.0 112.488 176.656 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 24.3 p90 -142.71 156.84 45.08 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 113.959 1.096 . . . . 0.0 113.959 -172.743 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 57.3 t -106.37 135.5 44.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 C-N-CA 126.432 1.893 . . . . 0.0 107.662 169.595 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 20.9 tp -104.57 135.96 45.01 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.639 0.775 . . . . 0.0 110.59 171.656 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -127.92 156.06 43.21 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.293 1.437 . . . . 0.0 111.577 -170.035 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 16.2 t90 -129.39 136.03 49.45 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.778 1.231 . . . . 0.0 111.69 -179.607 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -135.84 145.89 46.9 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.399 1.08 . . . . 0.0 112.815 -176.726 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 77.8 ttt-85 -103.39 141.78 35.36 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.328 1.451 . . . . 0.0 108.85 168.883 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 31.5 mtp -90.29 145.36 25.04 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 118.747 0.703 . . . . 0.0 112.113 178.15 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 70.8 m -95.81 154.86 38.96 Favored Pre-proline 0 CA--C 1.546 0.82 0 C-N-CA 125.175 1.39 . . . . 0.0 111.182 173.526 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -65.44 -23.4 58.2 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 123.175 2.584 . . . . 0.0 113.088 179.435 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 14.6 m -76.96 9.38 2.97 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.087 1.355 . . . . 0.0 113.534 172.398 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . 0.323 0.0 OUTLIER 70.95 20.84 5.19 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 128.891 2.876 . . . . 0.0 114.555 179.545 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -93.66 -174.31 3.43 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.766 1.226 . . . . 0.0 110.949 170.605 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.5 p -144.15 152.56 41.07 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 126.382 1.873 . . . . 0.0 110.317 -175.546 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -128.68 133.15 48.12 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.436 1.094 . . . . 0.0 111.083 172.937 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -78.07 128.3 33.63 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.834 0.854 . . . . 0.0 111.173 -179.95 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 61.4 mt -100.25 -51.02 3.77 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.819 1.248 . . . . 0.0 111.414 -170.342 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -171.09 173.33 5.07 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.582 1.953 . . . . 0.0 110.483 -176.663 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -158.63 161.64 37.2 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.3 1.44 . . . . 0.0 112.077 -176.977 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -141.23 125.5 10.38 Favored Pre-proline 0 CA--C 1.548 0.889 0 C-N-CA 125.148 1.379 . . . . 0.0 110.192 172.549 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -53.9 152.98 16.94 Favored 'Cis proline' 0 C--N 1.351 0.661 0 CA-C-N 120.257 1.128 . . . . 0.0 113.144 -9.025 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -62.78 140.67 58.77 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 -169.805 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 39.4 t0 -85.09 74.41 10.5 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.192 1.397 . . . . 0.0 110.071 173.95 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 20.8 mmm180 -76.15 -8.05 56.16 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -172.677 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 34.4 m -62.51 -32.53 73.47 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 -170.75 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -135.81 153.33 77.15 Favored Pre-proline 0 CA--C 1.546 0.79 0 C-N-CA 127.097 2.159 . . . . 0.0 110.298 172.088 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_exo -58.46 142.99 98.38 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.482 2.788 . . . . 0.0 112.279 171.358 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -80.98 -31.55 34.89 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-O 119.29 -0.728 . . . . 0.0 113.364 179.978 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 73.18 -52.58 0.71 Allowed 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 128.857 2.863 . . . . 0.0 113.144 174.023 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -80.76 61.65 4.5 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 126.301 1.84 . . . . 0.0 110.582 173.526 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 28.7 m -62.05 -6.59 3.05 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.767 1.627 . . . . 0.0 115.157 -172.706 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 8.8 ptp180 -61.55 -26.18 67.78 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 113.666 0.988 . . . . 0.0 113.666 170.587 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -93.35 135.62 34.39 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.165 0.986 . . . . 0.0 111.634 -179.349 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 52.6 mtm180 -139.96 153.12 46.82 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.776 1.23 . . . . 0.0 112.255 177.937 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 63.6 t -126.5 125.55 67.48 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 125.265 1.426 . . . . 0.0 108.094 168.139 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 87.2 m -130.43 126.62 37.46 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.249 1.02 . . . . 0.0 110.235 -178.414 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -80.89 139.87 35.66 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.654 0.781 . . . . 0.0 110.748 174.369 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 16.3 mt -80.85 158.46 70.44 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 124.078 0.951 . . . . 0.0 111.585 177.117 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -65.08 -4.21 8.6 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 123.429 2.752 . . . . 0.0 114.99 179.142 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -70.59 -25.97 63.3 Favored 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 120.562 1.528 . . . . 0.0 112.467 169.908 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 96.58 -3.94 63.6 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 126.214 1.864 . . . . 0.0 114.628 173.701 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 31.2 ptt180 -154.62 73.71 0.91 Allowed 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.937 1.695 . . . . 0.0 110.501 176.17 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -178.02 143.02 0.3 Allowed 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 128.951 2.9 . . . . 0.0 107.905 179.389 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -146.46 136.83 23.82 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.489 0.661 . . . . 0.0 112.757 -168.693 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -98.73 125.55 44.08 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.257 1.423 . . . . 0.0 111.615 170.066 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -104.23 103.24 12.98 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 127.172 2.189 . . . . 0.0 108.39 175.184 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 54.5 p -117.12 132.63 56.62 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 114.842 1.423 . . . . 0.0 114.842 -169.491 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 12.3 t -96.36 111.31 26.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 126.109 1.763 . . . . 0.0 106.961 167.312 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 94.3 t -78.38 127.94 38.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 124.785 1.234 . . . . 0.0 109.302 175.061 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 13.8 tpt180 57.79 54.53 6.14 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.874 1.27 . . . . 0.0 111.092 174.882 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.47 136.85 58.1 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.226 -0.921 . . . . 0.0 113.171 -168.723 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 45.4 mmm-85 -111.38 160.53 16.98 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 125.553 1.541 . . . . 0.0 111.021 -179.248 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 77.3 mtm180 -55.84 -22.59 25.8 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 113.515 0.932 . . . . 0.0 113.515 172.323 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -56.72 -35.51 68.64 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.754 1.621 . . . . 0.0 113.654 168.322 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -83.89 -23.3 31.31 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.862 0.865 . . . . 0.0 112.99 -168.595 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 48.8 m -49.69 139.29 13.03 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.789 1.236 . . . . 0.0 113.119 177.417 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 148.13 -165.87 28.96 Favored Glycine 0 N--CA 1.472 1.033 0 C-N-CA 124.326 0.965 . . . . 0.0 113.359 -176.287 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.2 m -92.35 142.69 27.17 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.982 1.313 . . . . 0.0 110.533 -178.093 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 45.1 m-85 -135.5 161.16 36.27 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.848 1.659 . . . . 0.0 111.91 -179.299 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -148.95 153.28 37.74 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.747 1.219 . . . . 0.0 112.245 172.927 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 49.6 t -101.32 155.4 18.06 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.648 1.579 . . . . 0.0 110.221 169.85 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -163.29 133.6 3.11 Favored Glycine 0 N--CA 1.471 0.999 0 N-CA-C 115.345 0.898 . . . . 0.0 115.345 174.587 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -94.97 157.3 15.96 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.47 1.108 . . . . 0.0 112.76 179.793 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 18.9 tt -152.59 135.41 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 125.065 1.346 . . . . 0.0 110.184 174.673 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 69.7 p -75.53 161.57 29.06 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.68 0.792 . . . . 0.0 113.002 178.2 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.51 -3.39 8.49 Favored 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 115.51 1.67 . . . . 0.0 115.51 178.709 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -73.84 144.18 82.4 Favored Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 124.468 1.107 . . . . 0.0 112.652 -176.306 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -56.53 -32.86 91.14 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 123.362 2.708 . . . . 0.0 113.754 172.502 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.09 4.34 34.61 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 115.046 1.499 . . . . 0.0 115.046 -179.604 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.31 160.32 24.78 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.324 1.05 . . . . 0.0 113.789 -173.833 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -145.34 162.82 36.32 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.821 1.649 . . . . 0.0 110.124 175.017 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 57.8 mt -80.68 119.2 29.78 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 123.62 0.768 . . . . 0.0 111.429 -169.973 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -82.37 93.33 7.16 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.398 1.479 . . . . 0.0 108.303 168.605 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 60.2 mt-10 -79.37 144.49 34.12 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.652 0.781 . . . . 0.0 112.743 -174.658 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 50.2 m -87.37 169.28 12.4 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.814 1.245 . . . . 0.0 113.277 169.776 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 94.2 mt -65.65 150.62 48.16 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.574 0.75 . . . . 0.0 109.888 168.003 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? -76.77 148.23 36.79 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.42 0.688 . . . . 0.0 112.373 -172.531 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -117.95 166.35 12.61 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.429 1.891 . . . . 0.0 110.596 170.093 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -126.36 139.02 53.61 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.656 1.182 . . . . 0.0 111.061 176.84 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 63.7 tp -106.8 131.37 53.99 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.45 1.5 . . . . 0.0 109.531 169.82 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -121.7 109.54 14.85 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.322 1.449 . . . . 0.0 109.199 170.302 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 24.1 t -95.95 114.36 32.48 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 169.979 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 68.9 p -95.73 146.14 24.75 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.452 1.501 . . . . 0.0 109.612 -179.787 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -63.15 148.34 48.26 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 121.627 0.727 . . . . 0.0 112.539 -175.968 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 34.2 ttm180 -75.37 119.74 19.87 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 124.156 0.982 . . . . 0.0 110.02 -175.551 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 31.1 ttp180 -72.17 149.17 44.92 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.416 0.687 . . . . 0.0 111.898 -175.429 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -66.37 154.31 40.43 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.692 0.797 . . . . 0.0 110.416 167.301 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 . . . . . 0 C--O 1.252 1.229 0 CA-C-O 117.669 -1.157 . . . . 0.0 113.454 -177.1 . . . . . . . . 0 0 . 1 stop_ save_