data_2n06_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 2n06 _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 31.1 m . . . . . 0 N--CA 1.483 1.181 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 42.7 mtm180 -86.83 143.14 34.99 Favored Pre-proline 0 N--CA 1.48 1.055 0 O-C-N 121.304 -0.873 . . . . 0.0 111.862 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -81.48 -179.28 4.82 Favored 'Trans proline' 0 CA--C 1.535 0.529 0 C-N-CA 124.371 3.381 . . . . 0.0 112.447 173.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.9 ttmt -70.38 149.68 47.05 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.034 0.534 . . . . 0.0 109.932 175.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 85.4 mt -62.44 -41.76 75.8 Favored Pre-proline 0 N--CA 1.478 0.933 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 -168.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -63.33 -29.81 72.76 Favored 'Trans proline' 0 C--N 1.349 0.582 0 CA-C-N 121.58 1.6 . . . . 0.0 114.001 171.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 7.9 tp -64.68 -42.01 95.66 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 119.591 1.087 . . . . 0.0 110.549 172.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.1 tt -64.34 -35.09 79.73 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.012 0.925 . . . . 0.0 111.792 174.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -66.3 -41.39 89.83 Favored 'General case' 0 N--CA 1.483 1.219 0 O-C-N 120.954 -1.091 . . . . 0.0 113.089 170.159 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 74.5 mt -62.46 -39.0 82.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 CA-C-N 119.413 1.006 . . . . 0.0 111.179 173.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 52.4 mt -65.3 -42.12 93.4 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.083 0.953 . . . . 0.0 111.919 173.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 34.4 m170 -61.56 -41.13 96.93 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.15 -0.969 . . . . 0.0 112.172 171.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.54 -27.52 69.02 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.89 0.876 . . . . 0.0 112.964 176.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.66 -3.55 31.98 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.303 1.041 . . . . 0.0 113.515 172.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 92.28 6.83 64.3 Favored Glycine 0 CA--C 1.537 1.449 0 C-N-CA 125.542 1.544 . . . . 0.0 114.821 -178.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -85.49 168.34 14.63 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 118.745 1.272 . . . . 0.0 113.327 179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 22.2 tm0? -135.36 140.89 45.39 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.712 1.605 . . . . 0.0 108.157 168.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 175.03 172.93 40.39 Favored Glycine 0 CA--C 1.526 0.73 0 N-CA-C 115.512 0.965 . . . . 0.0 115.512 -176.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -133.23 -58.25 0.9 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 126.227 1.811 . . . . 0.0 109.889 173.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 21.5 mtm -95.62 137.26 34.93 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.049 1.739 . . . . 0.0 111.568 175.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 84.6 m-85 -150.45 138.4 20.08 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.719 1.208 . . . . 0.0 112.532 -178.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 51.1 p -81.94 169.57 16.63 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.164 0.986 . . . . 0.0 110.477 168.172 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -56.39 -36.59 47.51 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 O-C-N 120.459 -1.401 . . . . 0.0 111.434 172.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 54.9 tptt -68.03 -44.79 75.68 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.726 1.211 . . . . 0.0 112.56 176.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 58.5 mt-10 -66.1 -36.81 84.16 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.206 0.602 . . . . 0.0 112.014 176.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 66.8 t -61.87 -50.37 80.43 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 C-N-CA 123.25 0.62 . . . . 0.0 110.409 170.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.35 -39.16 93.78 Favored 'General case' 0 C--N 1.334 -0.094 0 C-N-CA 126.261 1.824 . . . . 0.0 114.279 -172.338 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 83.1 t60 -51.59 -52.57 46.44 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 122.732 0.413 . . . . 0.0 111.309 174.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -74.79 -32.68 62.07 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 115.103 1.519 . . . . 0.0 115.103 174.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -70.25 -40.68 74.28 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 120.779 1.627 . . . . 0.0 112.89 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -60.62 -47.35 91.59 Favored Glycine 0 CA--C 1.53 0.978 0 N-CA-C 110.914 -0.875 . . . . 0.0 110.914 171.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 11.6 tp60 -57.17 -42.37 80.98 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.296 1.038 . . . . 0.0 112.503 173.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -63.96 -51.54 63.87 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.817 1.247 . . . . 0.0 110.784 178.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 37.1 mt -61.66 -37.74 78.69 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 C-N-CA 123.869 0.868 . . . . 0.0 110.793 178.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 34.9 mmt -66.73 -43.16 84.93 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 174.047 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 7.4 p -78.49 -28.6 14.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 CA-C-N 119.894 1.225 . . . . 0.0 113.386 -176.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 20.2 mmtp -91.13 -15.81 28.81 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.052 1.341 . . . . 0.0 113.458 173.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 14.6 mp0 54.18 63.34 2.21 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.078 1.751 . . . . 0.0 112.707 -174.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 13.6 tp -92.3 12.59 21.97 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.047 1.339 . . . . 0.0 111.961 -178.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 32.9 p90 -123.02 160.68 25.8 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 128.482 2.713 . . . . 0.0 110.625 -177.115 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.2 t0 -92.82 128.61 38.75 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 169.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.27 -30.95 52.4 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 179.709 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -94.11 -16.41 23.8 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.004 1.322 . . . . 0.0 112.559 -172.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -139.57 59.46 1.59 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 127.43 2.292 . . . . 0.0 109.83 -177.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -63.23 -17.75 62.79 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.526 0.73 . . . . 0.0 111.961 -178.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 6.4 p-80 -63.91 -1.39 1.41 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.353 1.461 . . . . 0.0 113.429 168.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 36.3 mtp -128.03 145.43 50.99 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 120.293 1.406 . . . . 0.0 111.618 168.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.7 t -127.36 140.26 49.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 125.484 1.514 . . . . 0.0 108.208 173.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 -112.74 52.61 0.77 Allowed 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.378 1.071 . . . . 0.0 113.818 -168.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 32.6 m -70.5 1.73 4.78 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -176.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.57 -25.45 55.36 Favored Glycine 0 CA--C 1.541 1.69 0 CA-C-N 120.558 1.527 . . . . 0.0 114.185 169.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -89.26 5.87 83.86 Favored Glycine 0 CA--C 1.542 1.727 0 C-N-CA 125.375 1.464 . . . . 0.0 115.327 171.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -109.46 172.36 6.9 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.335 1.854 . . . . 0.0 112.058 -174.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 88.5 mt -55.02 -35.62 64.62 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 120.986 -1.071 . . . . 0.0 112.352 169.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.1 tp -60.46 -42.58 96.49 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.738 0.815 . . . . 0.0 111.116 174.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -65.92 -44.36 91.95 Favored Glycine 0 CA--C 1.529 0.937 0 C-N-CA 125.378 1.466 . . . . 0.0 113.627 172.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.2 -26.91 65.96 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.376 1.588 . . . . 0.0 112.356 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 28.2 tp -71.83 -54.56 9.77 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.036 1.334 . . . . 0.0 111.996 169.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -88.64 -5.15 58.34 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-N 118.771 0.714 . . . . 0.0 112.71 -170.613 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 78.69 -27.89 2.17 Favored Glycine 0 CA--C 1.54 1.605 0 C-N-CA 126.131 1.824 . . . . 0.0 113.291 -170.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.81 134.85 9.0 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 128.28 2.632 . . . . 0.0 109.741 176.317 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -145.17 28.39 1.22 Allowed 'General case' 0 N--CA 1.476 0.863 0 O-C-N 121.3 -0.875 . . . . 0.0 110.876 174.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 14.9 m -87.92 135.61 33.33 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 121.59 -0.694 . . . . 0.0 109.387 170.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 17.5 p90 -158.26 168.75 26.18 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 123.84 0.856 . . . . 0.0 113.215 -169.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 14.9 t -110.26 136.19 49.84 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 122.373 1.082 . . . . 0.0 112.217 170.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -78.09 -13.66 13.93 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-N 114.08 -1.418 . . . . 0.0 114.115 -171.321 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 47.5 pttt -81.26 -7.31 59.55 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 125.867 1.667 . . . . 0.0 115.034 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -119.36 85.22 30.66 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 126.07 1.748 . . . . 0.0 110.828 -172.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.25 -27.32 56.15 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.953 3.102 . . . . 0.0 115.261 -172.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 68.2 m -63.59 -55.89 30.8 Favored Pre-proline 0 N--CA 1.478 0.928 0 CA-C-N 119.924 1.238 . . . . 0.0 114.036 -177.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -66.81 -29.55 42.01 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 121.872 1.715 . . . . 0.0 112.341 175.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 25.4 tp -65.48 -43.05 91.46 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.069 0.948 . . . . 0.0 111.583 176.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -60.49 -39.56 88.14 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 121.702 -0.624 . . . . 0.0 111.968 173.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -61.68 -43.28 99.16 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.244 0.618 . . . . 0.0 112.521 176.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 38.2 mtm -64.04 -49.83 70.84 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 173.059 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 65.7 mt -53.25 -48.16 68.46 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.886 1.274 . . . . 0.0 110.855 177.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.64 -18.51 12.38 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.745 1.618 . . . . 0.0 114.881 176.371 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -96.9 -22.51 16.84 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 125.955 1.702 . . . . 0.0 114.0 172.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -105.28 -26.98 11.79 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 119.818 1.19 . . . . 0.0 113.808 -175.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 3.0 tt . . . . . 0 CA--C 1.54 0.575 0 C-N-CA 125.817 1.647 . . . . 0.0 106.937 169.062 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 23.6 m . . . . . 0 N--CA 1.478 0.954 0 CA-C-O 121.025 0.441 . . . . 0.0 111.778 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 30.8 ttt180 -101.31 123.24 45.41 Favored Pre-proline 0 N--CA 1.476 0.848 0 C-N-CA 124.651 1.181 . . . . 0.0 110.503 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.0 162.31 40.48 Favored 'Trans proline' 0 CA--C 1.535 0.553 0 C-N-CA 123.061 2.507 . . . . 0.0 113.197 170.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.3 tpmt? -61.38 150.42 35.3 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.476 1.11 . . . . 0.0 110.121 175.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 88.3 mt -60.73 -41.6 83.36 Favored Pre-proline 0 N--CA 1.478 0.936 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -170.28 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -65.09 -26.7 57.68 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 121.952 1.768 . . . . 0.0 114.02 172.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.2 tt -72.49 -45.91 57.24 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.06 0.944 . . . . 0.0 109.988 172.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.3 tt -57.79 -33.57 68.69 Favored 'General case' 0 N--CA 1.477 0.919 0 O-C-N 120.782 -1.199 . . . . 0.0 112.237 173.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.75 -28.14 69.76 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 113.742 1.015 . . . . 0.0 113.742 170.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 68.8 mt -67.33 -45.93 84.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 CA-C-N 119.74 1.155 . . . . 0.0 110.319 171.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.03 -40.66 90.08 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.275 0.63 . . . . 0.0 111.015 176.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.8 m170 -64.99 -42.74 94.25 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.758 -0.589 . . . . 0.0 112.51 173.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.34 -28.97 70.07 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.15 -0.969 . . . . 0.0 112.983 176.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.46 -6.08 44.1 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.428 1.091 . . . . 0.0 113.308 172.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.66 7.58 64.67 Favored Glycine 0 CA--C 1.537 1.464 0 C-N-CA 125.374 1.464 . . . . 0.0 115.129 -179.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -88.21 167.58 13.47 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 118.752 1.276 . . . . 0.0 112.745 177.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.8 tm0? -126.71 141.78 51.74 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.286 1.434 . . . . 0.0 109.551 169.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 174.92 167.5 34.29 Favored Glycine 0 N--CA 1.465 0.629 0 N-CA-C 114.726 0.65 . . . . 0.0 114.726 -178.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -126.8 -59.68 1.26 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.57 1.548 . . . . 0.0 109.734 170.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.0 mpp? -93.72 139.98 30.19 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 126.079 1.752 . . . . 0.0 111.126 170.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -146.53 138.97 25.08 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.425 1.49 . . . . 0.0 111.506 178.083 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 41.1 p -74.25 170.52 15.41 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 121.274 -0.891 . . . . 0.0 110.911 168.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.9 t -55.43 -40.53 58.39 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 120.349 -1.469 . . . . 0.0 110.891 169.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -66.96 -43.63 82.63 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.314 1.046 . . . . 0.0 112.695 179.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 64.6 mt-10 -69.79 -33.48 72.44 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 176.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 52.2 t -61.93 -54.87 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 CA-C-N 118.663 0.665 . . . . 0.0 109.49 169.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.3 ttm -61.75 -37.26 83.6 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 126.941 2.096 . . . . 0.0 114.586 -173.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -51.7 -55.19 21.01 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.154 0.582 . . . . 0.0 111.827 172.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 60.0 m-85 -74.82 -30.0 61.25 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 174.338 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -71.67 -39.65 70.15 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 120.277 1.399 . . . . 0.0 112.677 -179.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.16 -39.87 98.21 Favored Glycine 0 CA--C 1.533 1.202 0 CA-C-N 119.395 0.998 . . . . 0.0 111.959 171.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 9.9 tp60 -64.57 -45.74 85.78 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.023 1.329 . . . . 0.0 112.215 172.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -61.35 -49.54 76.55 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 124.21 1.004 . . . . 0.0 109.901 178.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 56.7 mt -64.38 -33.63 64.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 C-N-CA 124.322 1.049 . . . . 0.0 111.032 178.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 5.5 tpt -63.46 -39.23 93.9 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 120.23 1.377 . . . . 0.0 112.127 169.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 99.3 t -78.17 -41.53 26.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 O-C-N 120.429 -1.419 . . . . 0.0 112.584 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 52.7 mmtt -85.97 -15.71 40.66 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.082 1.353 . . . . 0.0 112.654 -176.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 48.02 81.29 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 128.558 2.743 . . . . 0.0 114.307 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 37.0 mt -101.86 8.71 41.17 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 125.194 1.398 . . . . 0.0 113.381 -177.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 50.3 p90 -122.58 164.02 18.94 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.325 1.85 . . . . 0.0 111.456 -175.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -91.32 133.46 35.41 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.79 -0.569 . . . . 0.0 111.369 174.232 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.2 -20.92 60.85 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 120.902 -1.124 . . . . 0.0 113.902 173.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -81.79 -32.03 31.53 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.543 1.137 . . . . 0.0 111.157 179.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -146.2 74.4 1.37 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 127.604 2.361 . . . . 0.0 110.311 -169.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 29.1 mp0 -60.41 -23.9 64.73 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 120.859 -1.151 . . . . 0.0 112.58 178.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 5.6 p-80 -67.4 -6.91 21.28 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.385 1.474 . . . . 0.0 114.502 171.065 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 1.9 tpt -111.98 126.77 55.5 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 126.749 2.02 . . . . 0.0 109.726 173.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.4 t -126.07 133.77 68.1 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.766 1.227 . . . . 0.0 110.062 -178.113 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -118.51 100.12 7.25 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.929 1.692 . . . . 0.0 109.086 173.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 61.4 m -99.43 14.51 29.51 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.509 0.724 . . . . 0.0 112.737 175.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.19 -27.25 68.77 Favored Glycine 0 CA--C 1.538 1.527 0 O-C-N 120.639 -1.288 . . . . 0.0 114.518 -177.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -90.03 4.61 83.17 Favored Glycine 0 CA--C 1.54 1.639 0 C-N-CA 125.145 1.355 . . . . 0.0 114.995 172.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -106.89 172.01 7.05 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.772 1.629 . . . . 0.0 112.669 -174.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 10.9 mp -53.45 -34.12 56.68 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.396 1.478 . . . . 0.0 112.663 169.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 98.7 mt -61.08 -47.15 87.67 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 121.111 -0.993 . . . . 0.0 111.654 170.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -63.3 -38.6 96.7 Favored Glycine 0 CA--C 1.533 1.171 0 CA-C-O 119.16 -0.8 . . . . 0.0 112.889 173.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.65 -29.66 62.47 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 119.715 1.758 . . . . 0.0 112.973 -179.497 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.1 pp -81.4 -34.72 31.45 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 175.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -100.4 -9.68 21.96 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 119.17 0.895 . . . . 0.0 113.15 -177.404 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.49 -27.1 3.33 Favored Glycine 0 CA--C 1.54 1.634 0 C-N-CA 125.525 1.536 . . . . 0.0 112.905 -169.298 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.68 138.36 6.05 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 128.032 2.533 . . . . 0.0 111.282 178.512 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -144.21 69.2 1.27 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.836 0.854 . . . . 0.0 109.149 168.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -105.02 124.88 50.3 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 169.421 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 49.8 p90 -157.22 156.03 31.85 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.18 0.992 . . . . 0.0 112.118 -169.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 10.5 m -107.65 135.8 48.48 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.076 171.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . 0.264 0.2 OUTLIER -78.23 -14.5 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 -169.412 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -75.5 -7.9 55.33 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 125.562 1.545 . . . . 0.0 114.832 174.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -116.67 95.35 45.97 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 126.719 2.008 . . . . 0.0 110.334 -172.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -62.45 -28.36 77.91 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.965 3.11 . . . . 0.0 115.249 -178.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 67.3 m -58.85 -53.89 61.84 Favored Pre-proline 0 N--CA 1.477 0.885 0 CA-C-N 120.121 1.328 . . . . 0.0 113.834 -178.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -65.52 -28.31 53.56 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 122.099 1.866 . . . . 0.0 113.187 174.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 49.4 mt -62.92 -50.89 69.07 Favored 'General case' 0 C--N 1.344 0.356 0 CA-C-N 119.6 1.091 . . . . 0.0 111.13 174.009 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -60.48 -40.84 92.76 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 118.883 -0.579 . . . . 0.0 112.146 174.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -61.46 -49.65 75.97 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 119.229 0.922 . . . . 0.0 112.845 179.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 31.4 mtm -60.78 -49.64 76.67 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.657 0.783 . . . . 0.0 112.211 175.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 10.2 mp -65.97 -42.38 89.96 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 118.542 -0.742 . . . . 0.0 111.814 -176.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -57.28 -20.27 27.0 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 119.835 1.198 . . . . 0.0 113.842 172.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 90.4 mttt -95.84 -13.87 23.68 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.77 1.628 . . . . 0.0 114.404 174.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 8.1 p-10 -124.8 -16.33 6.21 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 116.154 1.909 . . . . 0.0 116.154 -178.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 57.4 tp . . . . . 0 CA--C 1.537 0.451 0 C-N-CA 127.358 2.263 . . . . 0.0 108.858 176.434 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 32.6 m . . . . . 0 N--CA 1.483 1.198 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 24.0 ttp-105 -99.49 134.47 21.15 Favored Pre-proline 0 N--CA 1.481 1.111 0 O-C-N 120.847 -1.158 . . . . 0.0 111.802 178.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -71.46 171.29 16.51 Favored 'Trans proline' 0 C--N 1.354 0.832 0 C-N-CA 123.624 2.883 . . . . 0.0 112.65 175.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.6 tpmt? -62.01 146.66 49.52 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.251 1.02 . . . . 0.0 110.739 178.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 90.2 mt -55.3 -49.22 93.64 Favored Pre-proline 0 N--CA 1.474 0.769 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 -173.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -65.11 -21.09 63.22 Favored 'Trans proline' 0 CA--C 1.54 0.807 0 CA-C-N 122.034 1.762 . . . . 0.0 113.856 177.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.2 tt -75.72 -46.36 31.52 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.247 0.93 . . . . 0.0 109.657 169.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.1 tp -57.01 -34.62 68.36 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.246 -0.909 . . . . 0.0 113.285 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -64.3 -22.4 66.94 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 121.271 -0.893 . . . . 0.0 113.34 175.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 51.7 mt -70.23 -39.67 77.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 123.93 0.892 . . . . 0.0 110.363 171.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.9 mp -70.01 -35.37 74.31 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.347 -0.846 . . . . 0.0 111.279 175.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 57.7 m170 -61.03 -46.32 91.23 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 118.208 0.458 . . . . 0.0 111.263 169.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.65 -24.68 67.89 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 175.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.58 -6.31 39.81 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 172.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.72 17.59 47.98 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 125.039 1.304 . . . . 0.0 115.069 177.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -121.13 150.01 41.91 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.043 1.337 . . . . 0.0 112.71 -179.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -74.46 171.12 14.34 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.486 0.714 . . . . 0.0 111.548 169.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -169.06 133.1 2.74 Favored Glycine 0 C--N 1.341 0.817 0 N-CA-C 117.487 1.755 . . . . 0.0 117.487 -178.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -140.56 -13.41 0.99 Allowed 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 173.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 3.2 mtm -171.04 134.08 0.92 Allowed 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 126.539 1.936 . . . . 0.0 111.391 -175.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -155.1 147.5 24.0 Favored 'General case' 0 CA--C 1.55 0.974 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 -173.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 50.7 p -94.97 171.84 8.51 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 127.106 2.162 . . . . 0.0 110.371 168.234 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -52.09 -48.02 42.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 CA-C-N 120.356 1.435 . . . . 0.0 110.428 169.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -53.32 -37.84 62.65 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.114 0.966 . . . . 0.0 113.091 -179.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -80.82 -42.98 20.75 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.248 1.019 . . . . 0.0 112.726 176.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 75.6 t -64.18 -48.32 86.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 O-C-N 120.851 -1.156 . . . . 0.0 111.775 -179.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.4 mmm -72.66 -25.8 61.4 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 118.906 0.775 . . . . 0.0 112.421 -174.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 77.1 t60 -60.56 -54.52 44.44 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.678 0.791 . . . . 0.0 110.804 169.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 53.6 m-85 -72.37 -32.62 66.58 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 113.58 0.955 . . . . 0.0 113.58 179.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.9 mp -69.91 -40.64 75.48 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.882 1.219 . . . . 0.0 112.197 172.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.22 -42.91 99.72 Favored Glycine 0 CA--C 1.529 0.959 0 CA-C-N 118.979 0.809 . . . . 0.0 111.847 172.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.7 tp60 -58.52 -47.03 85.51 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.554 1.141 . . . . 0.0 111.973 171.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -60.7 -49.59 76.9 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.323 0.649 . . . . 0.0 110.752 175.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 54.6 mt -57.68 -37.83 61.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 124.868 1.267 . . . . 0.0 111.125 177.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -69.24 -37.56 78.05 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.876 0.87 . . . . 0.0 113.136 174.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 81.4 t -78.23 -31.5 16.34 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 124.179 0.992 . . . . 0.0 112.524 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 54.3 mmtt -92.34 -14.72 28.32 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.894 1.278 . . . . 0.0 113.152 176.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.7 mp0 53.61 61.16 3.24 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.467 1.907 . . . . 0.0 113.134 -172.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.4 mp -95.69 6.16 49.62 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.003 1.321 . . . . 0.0 113.539 -179.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 52.4 p90 -89.88 158.95 17.2 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.823 1.649 . . . . 0.0 110.691 169.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -85.27 123.37 30.67 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.589 -0.694 . . . . 0.0 110.904 170.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.4 -22.07 66.74 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 120.895 -1.128 . . . . 0.0 112.865 178.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 48.2 mm-40 -78.7 -26.94 44.92 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.357 -0.839 . . . . 0.0 111.035 -176.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -160.25 83.71 0.71 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 127.189 2.196 . . . . 0.0 110.906 -171.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -60.58 -14.24 18.96 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.626 1.57 . . . . 0.0 115.089 -169.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 22.6 p80 -65.31 -23.44 67.02 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 118.112 -0.947 . . . . 0.0 113.082 171.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 42.3 mmm -83.88 139.91 32.32 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 119.67 1.123 . . . . 0.0 112.843 173.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 60.4 t -120.86 133.45 67.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 127.794 2.437 . . . . 0.0 107.0 169.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 10.5 t80 -121.38 13.34 11.04 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 116.833 2.161 . . . . 0.0 116.833 -168.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 15.9 p 39.06 31.33 0.05 OUTLIER 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 128.407 2.683 . . . . 0.0 117.542 175.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.34 108.34 1.89 Allowed Glycine 0 CA--C 1.534 1.269 0 O-C-N 120.897 -1.127 . . . . 0.0 113.348 -171.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 68.45 14.06 66.29 Favored Glycine 0 CA--C 1.54 1.62 0 C-N-CA 124.21 0.91 . . . . 0.0 114.895 -175.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -75.45 155.27 36.45 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 118.682 1.241 . . . . 0.0 112.265 -177.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 81.8 mt -62.53 -32.5 73.46 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.412 1.485 . . . . 0.0 111.56 169.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 84.8 mt -54.81 -48.04 73.3 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.7 0.8 . . . . 0.0 111.354 171.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -71.78 -38.76 60.66 Favored Glycine 0 CA--C 1.53 0.976 0 C-N-CA 124.42 1.009 . . . . 0.0 112.989 178.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.93 -26.62 65.17 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 119.673 1.736 . . . . 0.0 112.481 177.457 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 47.7 tp -76.12 -56.32 4.76 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.397 1.479 . . . . 0.0 112.181 173.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.31 -7.73 41.01 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 113.469 0.915 . . . . 0.0 113.469 -169.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 80.66 -25.64 3.34 Favored Glycine 0 CA--C 1.539 1.558 0 C-N-CA 125.756 1.646 . . . . 0.0 113.34 -169.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.6 137.2 11.03 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 126.801 2.041 . . . . 0.0 112.058 178.264 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -148.14 49.06 1.05 Allowed 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.686 1.195 . . . . 0.0 110.429 168.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 8.1 p -89.85 137.53 32.26 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 121.327 -0.858 . . . . 0.0 110.063 169.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 46.6 p90 -171.82 167.95 6.2 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.519 0.728 . . . . 0.0 112.064 -169.151 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 60.2 p -121.21 143.83 48.93 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.071 -0.968 . . . . 0.0 113.51 173.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 27.1 m -74.39 -12.86 15.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 -179.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.39 -0.48 46.2 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.778 1.631 . . . . 0.0 114.586 170.5 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 40.8 t0 -126.85 77.39 74.65 Favored Pre-proline 0 CA--C 1.551 1.015 0 C-N-CA 127.135 2.174 . . . . 0.0 109.95 171.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_exo -56.64 -40.88 81.33 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 124.623 3.549 . . . . 0.0 114.882 -175.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 55.6 m -52.92 -54.86 39.24 Favored Pre-proline 0 N--CA 1.476 0.848 0 N-CA-C 114.838 1.421 . . . . 0.0 114.838 -172.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -65.81 -30.46 49.62 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 122.336 2.024 . . . . 0.0 113.425 175.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 37.0 tp -66.95 -47.28 72.13 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.003 0.921 . . . . 0.0 110.672 176.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -58.23 -40.53 81.93 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.721 0.808 . . . . 0.0 112.228 171.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -60.11 -51.04 71.31 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 119.729 1.15 . . . . 0.0 112.902 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 64.7 mtm -63.6 -44.5 93.8 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.034 0.534 . . . . 0.0 112.116 175.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 66.4 mt -61.5 -46.74 88.73 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-O 117.732 -1.128 . . . . 0.0 111.326 178.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 42.1 ttt180 -56.37 -24.98 47.9 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 121.265 1.848 . . . . 0.0 113.547 174.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -85.17 -17.9 35.77 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.561 1.544 . . . . 0.0 114.012 174.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -123.36 -6.39 8.22 Favored 'General case' 0 CA--C 1.558 1.273 0 N-CA-C 115.698 1.74 . . . . 0.0 115.698 178.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 68.8 tp . . . . . 0 CA--C 1.541 0.597 0 C-N-CA 128.512 2.725 . . . . 0.0 109.679 -174.079 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 33.7 m . . . . . 0 N--CA 1.48 1.074 0 N-CA-C 111.656 0.243 . . . . 0.0 111.656 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.3 ttp-105 -95.42 133.66 25.55 Favored Pre-proline 0 N--CA 1.48 1.037 0 O-C-N 120.991 -1.068 . . . . 0.0 111.522 172.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -68.38 171.44 12.88 Favored 'Trans proline' 0 C--N 1.354 0.857 0 C-N-CA 123.799 3.0 . . . . 0.0 113.501 176.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.5 ttmt -62.86 149.62 43.9 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.142 0.977 . . . . 0.0 110.685 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 81.3 mt -61.66 -43.11 87.12 Favored Pre-proline 0 N--CA 1.476 0.866 0 N-CA-C 115.062 1.504 . . . . 0.0 115.062 -168.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -65.0 -28.41 57.66 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.035 1.824 . . . . 0.0 113.752 172.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 5.1 tt -67.49 -49.19 64.63 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 119.221 0.919 . . . . 0.0 109.499 172.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 13.9 tp -60.24 -33.07 71.77 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 121.294 -0.879 . . . . 0.0 112.784 177.41 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -58.66 -27.69 65.02 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 174.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 60.0 mt -72.99 -39.13 57.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.17 0.988 . . . . 0.0 110.998 175.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.3 mp -68.08 -34.85 77.19 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.477 -0.764 . . . . 0.0 110.953 174.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 60.4 m170 -61.94 -44.58 96.47 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 121.998 -0.439 . . . . 0.0 111.513 169.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -65.02 -26.99 68.51 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 175.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.33 -3.41 26.97 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.352 1.061 . . . . 0.0 113.435 171.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.67 15.26 57.02 Favored Glycine 0 CA--C 1.535 1.317 0 C-N-CA 125.021 1.296 . . . . 0.0 115.309 174.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -117.13 145.34 43.86 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.943 1.297 . . . . 0.0 112.551 -179.114 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -75.06 170.69 15.51 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.255 0.622 . . . . 0.0 111.329 169.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -173.0 143.74 7.44 Favored Glycine 0 C--N 1.34 0.765 0 N-CA-C 117.324 1.69 . . . . 0.0 117.324 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -140.7 -11.22 1.02 Allowed 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 175.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.5 mtm -169.68 130.18 1.03 Allowed 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 125.744 1.618 . . . . 0.0 111.579 -175.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -155.82 139.5 16.06 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -175.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 64.8 p -80.77 176.02 10.17 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.792 0.837 . . . . 0.0 109.646 166.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -59.34 -37.64 70.41 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.324 0 O-C-N 120.262 -1.524 . . . . 0.0 111.651 172.381 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -66.97 -42.19 85.57 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.865 1.666 . . . . 0.0 113.059 175.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -70.34 -35.06 73.36 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.776 -0.577 . . . . 0.0 112.094 174.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 18.7 t -60.38 -48.91 86.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 124.085 0.954 . . . . 0.0 110.844 169.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -62.34 -36.43 82.16 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 127.097 2.159 . . . . 0.0 114.178 -173.176 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -51.7 -53.02 43.74 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 122.857 0.463 . . . . 0.0 111.956 170.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -74.7 -31.66 61.94 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 114.296 1.221 . . . . 0.0 114.296 175.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -72.14 -41.93 66.58 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.971 1.26 . . . . 0.0 112.876 -179.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -60.46 -42.94 99.22 Favored Glycine 0 CA--C 1.532 1.126 0 CA-C-N 118.826 0.739 . . . . 0.0 111.559 171.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.2 tp60 -61.61 -42.26 98.63 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.77 1.228 . . . . 0.0 112.648 173.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -64.45 -51.88 60.83 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.307 1.043 . . . . 0.0 110.42 177.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 55.8 mt -60.85 -37.4 76.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 O-C-N 121.501 -0.749 . . . . 0.0 110.597 179.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.2 tpt -63.88 -46.57 84.33 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.88 1.272 . . . . 0.0 112.892 173.59 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.3 p -78.5 -27.24 14.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 CA-C-N 119.73 1.15 . . . . 0.0 113.683 -176.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 55.0 mmtt -90.48 -15.72 30.27 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 125.074 1.349 . . . . 0.0 113.365 173.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.4 mp0 54.35 60.08 3.79 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 127.034 2.134 . . . . 0.0 113.105 -174.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.9 tp -95.62 6.18 49.6 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.08 0.952 . . . . 0.0 113.301 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 47.4 p90 -95.68 159.8 14.81 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 126.109 1.763 . . . . 0.0 111.022 173.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -86.07 129.24 34.9 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.518 -0.739 . . . . 0.0 111.836 172.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.35 -24.26 66.48 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 120.799 -1.188 . . . . 0.0 112.752 176.536 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 49.7 mm-40 -78.68 -30.57 46.23 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.28 -0.887 . . . . 0.0 110.756 -176.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -151.72 80.58 1.28 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 128.036 2.534 . . . . 0.0 110.159 -169.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 27.2 mp0 -60.76 -15.54 30.67 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 114.292 1.219 . . . . 0.0 114.292 -174.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 21.6 p80 -64.31 -22.51 66.98 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 118.402 -0.809 . . . . 0.0 113.113 171.548 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.8 ttm -96.88 137.27 36.23 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 119.838 1.199 . . . . 0.0 112.783 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 52.7 t -132.06 138.32 52.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 126.419 1.888 . . . . 0.0 110.18 -179.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -104.16 51.02 0.78 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.934 1.293 . . . . 0.0 113.889 -171.007 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 90.4 m -69.39 -1.61 8.82 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 115.321 1.6 . . . . 0.0 115.321 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.36 -25.19 60.1 Favored Glycine 0 CA--C 1.539 1.578 0 CA-C-N 120.462 1.483 . . . . 0.0 113.686 169.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -91.57 9.96 75.84 Favored Glycine 0 CA--C 1.54 1.653 0 C-N-CA 125.506 1.526 . . . . 0.0 115.064 170.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -119.6 174.83 6.17 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.539 1.536 . . . . 0.0 112.689 -173.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -49.84 -40.17 41.32 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.004 1.722 . . . . 0.0 111.933 176.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 63.1 mt -62.56 -38.12 88.83 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 120.746 0.307 . . . . 0.0 111.155 178.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -79.12 -29.09 52.16 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 125.381 1.467 . . . . 0.0 113.593 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -67.47 -42.23 83.33 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 120.491 2.145 . . . . 0.0 109.606 169.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 24.1 tp -60.66 -48.46 81.69 Favored 'General case' 0 CA--C 1.552 1.023 0 CA-C-N 114.974 -1.012 . . . . 0.0 112.76 177.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 8.1 mt -94.17 -7.39 42.42 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 116.044 1.868 . . . . 0.0 116.044 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.81 -16.33 11.93 Favored Glycine 0 CA--C 1.543 1.836 0 O-C-N 120.701 -1.249 . . . . 0.0 113.797 -169.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.23 155.35 26.88 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 129.024 2.93 . . . . 0.0 109.322 173.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -164.03 25.57 0.07 Allowed 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 119.229 0.922 . . . . 0.0 112.215 169.294 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 17.2 m -84.97 132.01 34.41 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 120.999 -1.063 . . . . 0.0 108.681 175.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 6.3 p90 -161.26 178.57 9.11 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 -167.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 96.7 p -122.88 137.67 54.87 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 114.423 -1.262 . . . . 0.0 113.314 173.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 15.3 m -73.74 -17.05 17.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 -173.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.7 pttt -82.53 -6.31 59.25 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.039 1.736 . . . . 0.0 115.046 -177.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -118.73 83.33 22.1 Favored Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 126.119 1.768 . . . . 0.0 110.585 -173.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.28 -30.69 54.1 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 124.083 3.189 . . . . 0.0 115.315 -169.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 66.9 m -61.72 -53.96 55.95 Favored Pre-proline 0 N--CA 1.475 0.817 0 CA-C-N 119.698 1.136 . . . . 0.0 113.995 -176.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -69.37 -28.38 27.18 Favored 'Trans proline' 0 C--N 1.354 0.818 0 C-N-CA 121.869 1.713 . . . . 0.0 112.764 175.109 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 18.7 tp -66.77 -44.51 81.19 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.884 1.274 . . . . 0.0 111.914 179.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -55.48 -39.09 69.98 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.8 1.24 . . . . 0.0 112.947 176.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -59.7 -47.18 86.67 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.717 0.807 . . . . 0.0 112.396 177.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 16.7 mtm -69.21 -41.85 76.54 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 178.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 65.9 mt -55.34 -54.96 37.06 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.441 1.096 . . . . 0.0 110.588 175.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 72.7 ttt180 -52.44 -31.97 37.17 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.247 1.419 . . . . 0.0 113.223 178.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -78.78 -29.57 45.1 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.272 1.429 . . . . 0.0 113.757 176.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 31.3 m-20 -109.74 -19.16 13.26 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -171.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 47.7 tp . . . . . 0 CA--C 1.535 0.4 0 C-N-CA 126.218 1.807 . . . . 0.0 106.436 168.42 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.4 m . . . . . 0 N--CA 1.483 1.175 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.1 ttp-105 -87.59 138.53 31.69 Favored Pre-proline 0 N--CA 1.481 1.094 0 C-N-CA 125.175 1.39 . . . . 0.0 111.814 178.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -73.89 177.75 7.73 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 123.959 3.106 . . . . 0.0 113.71 175.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 32.1 ttmt -69.86 155.21 40.9 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.456 1.102 . . . . 0.0 111.296 179.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 68.4 mt -56.25 -45.71 99.88 Favored Pre-proline 0 CA--C 1.544 0.726 0 N-CA-C 116.346 1.98 . . . . 0.0 116.346 -168.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -64.19 -29.46 64.62 Favored 'Trans proline' 0 C--N 1.351 0.693 0 CA-C-N 122.152 1.804 . . . . 0.0 113.262 175.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.3 tt -71.27 -42.53 68.64 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.068 0.849 . . . . 0.0 110.14 176.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 11.5 tp -58.57 -37.15 75.14 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.514 -0.741 . . . . 0.0 111.408 170.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.7 -37.09 85.5 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.146 0.979 . . . . 0.0 113.432 175.262 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 87.8 mt -62.57 -44.53 99.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 CA-C-N 119.043 0.838 . . . . 0.0 110.973 170.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 71.2 mt -62.39 -37.54 86.15 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.529 0.732 . . . . 0.0 111.857 175.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -63.43 -45.28 91.66 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 121.195 -0.941 . . . . 0.0 112.368 169.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.62 -27.06 68.97 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.017 0.927 . . . . 0.0 113.085 177.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.49 -7.29 46.57 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.352 1.061 . . . . 0.0 113.447 173.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 93.18 8.6 61.33 Favored Glycine 0 CA--C 1.537 1.447 0 C-N-CA 125.537 1.541 . . . . 0.0 114.952 -178.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -97.62 173.94 6.89 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.891 1.276 . . . . 0.0 113.062 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 15.5 tp60 -129.51 149.19 51.39 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 126.511 1.924 . . . . 0.0 108.92 169.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -158.68 148.92 18.73 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 116.421 1.328 . . . . 0.0 116.421 -174.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -133.41 -14.77 2.54 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.973 1.309 . . . . 0.0 113.829 174.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 6.0 mtm -175.41 137.18 0.37 Allowed 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 129.231 3.012 . . . . 0.0 109.367 -178.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -158.54 170.21 22.7 Favored 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 114.317 1.228 . . . . 0.0 114.317 174.062 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 70.5 p -90.44 171.62 9.3 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 126.295 1.838 . . . . 0.0 112.131 173.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.8 t -51.56 -44.08 33.19 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 123.634 0.774 . . . . 0.0 110.761 169.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -67.69 -42.86 81.4 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 125.155 1.382 . . . . 0.0 112.89 -179.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -72.52 -32.68 66.32 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 118.433 0.56 . . . . 0.0 112.469 179.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 43.7 t -63.87 -49.28 82.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 123.459 0.703 . . . . 0.0 109.703 169.155 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -65.22 -34.0 77.33 Favored 'General case' 0 N--CA 1.458 -0.072 0 C-N-CA 126.871 2.069 . . . . 0.0 114.301 -176.3 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -51.56 -52.9 43.38 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.543 0.737 . . . . 0.0 111.257 172.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -74.78 -32.83 62.15 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.896 1.443 . . . . 0.0 114.896 172.065 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.67 -41.41 75.54 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 120.674 1.579 . . . . 0.0 113.053 -178.507 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.27 -39.75 98.21 Favored Glycine 0 CA--C 1.533 1.178 0 CA-C-N 118.678 0.672 . . . . 0.0 111.817 173.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.5 tp60 -62.8 -45.33 93.16 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.786 1.234 . . . . 0.0 112.045 172.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -60.76 -49.71 76.41 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.896 0.879 . . . . 0.0 110.426 177.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 53.3 mt -62.21 -34.98 66.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 C-N-CA 124.019 0.928 . . . . 0.0 111.236 177.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.76 -38.61 91.58 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 119.575 1.08 . . . . 0.0 112.358 172.102 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 96.5 t -78.28 -34.76 18.88 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 C-N-CA 124.334 1.053 . . . . 0.0 112.998 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 19.0 mmtp -90.16 -14.94 32.51 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.961 1.304 . . . . 0.0 113.328 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.2 mp0 47.34 62.2 2.53 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 127.269 2.228 . . . . 0.0 113.876 -172.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 31.6 mt -82.66 -13.11 57.03 Favored 'General case' 0 N--CA 1.478 0.974 0 O-C-N 121.306 -0.871 . . . . 0.0 112.548 175.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 44.5 p90 -78.69 152.47 31.59 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.045 0.938 . . . . 0.0 111.744 176.12 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -83.41 127.2 33.49 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 121.834 -0.541 . . . . 0.0 110.619 169.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -65.8 -24.47 66.92 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.1 -1.0 . . . . 0.0 113.515 -176.654 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -85.5 -30.08 23.73 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-O 121.385 0.612 . . . . 0.0 111.337 -171.117 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -148.54 87.82 1.6 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 128.587 2.755 . . . . 0.0 110.064 178.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 29.2 mp0 -61.2 -14.24 24.03 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 -172.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 23.9 p80 -61.74 -30.76 70.99 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 118.278 -0.868 . . . . 0.0 112.378 170.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 21.5 tpp -83.07 128.53 34.57 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 119.781 1.173 . . . . 0.0 111.036 177.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 3.3 t -120.91 122.49 67.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 C-N-CA 126.106 1.762 . . . . 0.0 108.857 174.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -107.49 107.09 17.79 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.509 1.524 . . . . 0.0 109.796 178.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 84.2 m -99.8 20.04 14.91 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.253 1.021 . . . . 0.0 113.27 -177.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.69 122.98 31.85 Favored Glycine 0 CA--C 1.534 1.264 0 O-C-N 120.937 -1.102 . . . . 0.0 111.872 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 78.27 0.4 77.52 Favored Glycine 0 CA--C 1.54 1.65 0 C-N-CA 124.488 1.042 . . . . 0.0 115.374 -174.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -80.72 162.77 23.97 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 119.278 1.539 . . . . 0.0 111.657 171.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -46.47 -40.81 12.99 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.623 1.569 . . . . 0.0 111.743 170.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 97.1 mt -60.18 -43.66 95.68 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.088 0.955 . . . . 0.0 111.998 176.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -71.49 -34.15 63.62 Favored Glycine 0 CA--C 1.533 1.19 0 C-N-CA 124.99 1.281 . . . . 0.0 114.061 176.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -66.85 -42.64 85.4 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 120.637 2.219 . . . . 0.0 110.487 174.061 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 27.1 tp -61.51 -52.65 63.59 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 115.085 -0.961 . . . . 0.0 112.456 177.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -101.91 -6.8 23.06 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -169.568 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.86 -29.22 2.41 Favored Glycine 0 CA--C 1.54 1.651 0 O-C-N 120.349 -1.469 . . . . 0.0 112.805 -169.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.84 135.86 7.65 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 127.633 2.373 . . . . 0.0 111.926 179.012 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 11.6 mt-30 -142.38 45.84 1.62 Allowed 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.29 1.036 . . . . 0.0 109.831 168.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 1.6 m -86.33 128.41 34.92 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 121.161 -0.962 . . . . 0.0 109.184 169.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 17.8 p90 -158.02 168.63 26.59 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.496 0.718 . . . . 0.0 112.856 -169.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 34.6 t -118.61 138.04 52.85 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.828 170.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -77.53 -1.43 3.86 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 12.6 pttp -84.29 -7.81 59.22 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.565 1.146 . . . . 0.0 113.702 169.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -122.89 83.25 49.92 Favored Pre-proline 0 CA--C 1.55 0.981 0 C-N-CA 126.487 1.915 . . . . 0.0 110.819 -170.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -67.46 -27.88 39.28 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.88 3.054 . . . . 0.0 115.269 -170.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 59.6 m -61.79 -53.71 57.97 Favored Pre-proline 0 N--CA 1.477 0.902 0 CA-C-N 119.867 1.212 . . . . 0.0 114.192 -177.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -67.21 -29.98 38.35 Favored 'Trans proline' 0 C--N 1.353 0.777 0 C-N-CA 121.93 1.753 . . . . 0.0 112.636 175.225 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 27.9 tp -65.35 -44.14 88.64 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.408 1.083 . . . . 0.0 111.551 177.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 25.7 t80 -60.43 -36.39 78.07 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.865 1.266 . . . . 0.0 112.195 174.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -65.47 -47.17 77.03 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.664 0.785 . . . . 0.0 112.712 175.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 31.1 mtm -57.59 -49.66 75.68 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.024 0.53 . . . . 0.0 111.768 174.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 7.5 mp -63.11 -47.89 80.86 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-O 117.294 -1.336 . . . . 0.0 111.125 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 61.7 mtp180 -52.0 -29.65 21.73 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-N 121.067 1.758 . . . . 0.0 113.757 175.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -85.82 -20.21 29.5 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.594 1.557 . . . . 0.0 114.879 177.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -126.69 -25.64 3.36 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 115.29 1.589 . . . . 0.0 115.29 -174.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 44.7 tp . . . . . 0 CA--C 1.54 0.56 0 C-N-CA 127.619 2.368 . . . . 0.0 107.179 170.862 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 34.8 m . . . . . 0 N--CA 1.484 1.241 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.4 ptt-85 -94.29 156.98 38.25 Favored Pre-proline 0 N--CA 1.488 1.425 0 C-N-CA 124.65 1.18 . . . . 0.0 112.015 169.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -68.06 176.43 5.41 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 123.839 3.026 . . . . 0.0 112.756 169.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 24.4 ttmt -65.11 148.06 52.35 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.136 0.974 . . . . 0.0 111.2 179.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 81.8 mt -53.4 -50.74 81.15 Favored Pre-proline 0 N--CA 1.477 0.914 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -169.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -64.43 -22.07 65.96 Favored 'Trans proline' 0 CA--C 1.54 0.777 0 C-N-CA 122.262 1.975 . . . . 0.0 114.142 175.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.1 tt -77.9 -37.51 47.81 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 119.825 1.193 . . . . 0.0 110.54 169.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 16.2 tp -58.58 -35.09 71.86 Favored 'General case' 0 N--CA 1.475 0.775 0 O-C-N 120.765 -1.209 . . . . 0.0 112.264 171.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.426 ' HA ' ' HE2' ' A' ' 35' ' ' LYS . 9.0 mmpt? -59.84 -26.62 65.96 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 172.131 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 81.8 mt -73.04 -36.98 52.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 123.977 0.911 . . . . 0.0 110.662 176.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.4 mp -70.51 -34.3 72.17 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.152 -0.967 . . . . 0.0 111.279 172.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 43.6 m170 -63.15 -42.44 99.44 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.796 -0.565 . . . . 0.0 111.532 169.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.79 -28.54 69.94 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.153 0.981 . . . . 0.0 113.166 173.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.54 -6.51 36.87 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 124.153 0.981 . . . . 0.0 113.33 171.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 92.47 16.54 49.14 Favored Glycine 0 CA--C 1.535 1.344 0 C-N-CA 125.309 1.433 . . . . 0.0 115.142 177.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -123.76 139.99 53.43 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 118.77 1.285 . . . . 0.0 113.421 -176.316 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -77.04 151.86 35.36 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.164 0.986 . . . . 0.0 110.192 169.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -165.32 146.89 11.64 Favored Glycine 0 CA--C 1.527 0.834 0 N-CA-C 115.221 0.848 . . . . 0.0 115.221 176.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -137.58 -14.03 1.48 Allowed 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 114.687 1.365 . . . . 0.0 114.687 -175.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 5.9 mtm -176.45 126.35 0.19 Allowed 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 128.44 2.696 . . . . 0.0 109.658 -176.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -170.42 152.03 3.89 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 114.507 1.299 . . . . 0.0 114.507 176.572 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 42.9 p -75.41 175.32 8.55 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 126.351 1.861 . . . . 0.0 113.163 176.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 8.9 t -54.54 -50.1 61.29 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 O-C-N 120.614 -1.304 . . . . 0.0 110.401 169.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -56.43 -37.37 70.12 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.287 0.949 . . . . 0.0 112.587 -177.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -79.23 -30.79 43.38 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.687 1.195 . . . . 0.0 113.474 176.013 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 49.6 t -75.28 -46.05 39.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.124 0.97 . . . . 0.0 111.777 176.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 29.4 mmt -62.36 -26.81 68.66 Favored 'General case' 0 N--CA 1.483 1.221 0 CA-C-N 119.907 1.231 . . . . 0.0 113.116 -177.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -51.56 -52.95 43.04 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.18 170.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -74.88 -36.99 62.25 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 170.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -75.18 -41.47 57.94 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 120.831 -1.168 . . . . 0.0 112.898 -171.578 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -64.11 -35.92 92.59 Favored Glycine 0 CA--C 1.531 1.052 0 O-C-N 121.654 -0.654 . . . . 0.0 111.814 171.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 9.1 tp60 -64.48 -44.55 90.65 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.679 1.191 . . . . 0.0 111.912 171.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -60.21 -48.84 80.04 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.637 0.775 . . . . 0.0 110.364 175.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 58.1 mt -63.04 -35.27 70.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 124.108 0.963 . . . . 0.0 111.241 177.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.0 tpt -65.57 -35.7 81.62 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.447 1.099 . . . . 0.0 112.516 173.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 64.0 t -78.35 -47.74 23.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 O-C-N 120.848 -1.158 . . . . 0.0 112.29 175.11 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 18.2 mmtp -80.62 -13.43 59.05 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.52 1.128 . . . . 0.0 112.624 -174.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 51.79 63.95 2.04 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 127.901 2.48 . . . . 0.0 113.434 176.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 37.1 mt -86.6 -11.27 51.93 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.726 0.81 . . . . 0.0 112.729 178.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 45.4 p90 -84.73 154.61 22.33 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.208 1.003 . . . . 0.0 111.632 175.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -88.42 129.15 35.5 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 169.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.75 -31.02 57.97 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 113.876 1.065 . . . . 0.0 113.876 179.23 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -93.91 -17.71 22.71 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.721 1.209 . . . . 0.0 112.702 -172.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -140.84 64.01 1.44 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.837 2.455 . . . . 0.0 109.677 -177.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -62.96 -18.06 62.75 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 -171.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 27.7 p80 -61.1 -32.03 71.71 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.624 0.77 . . . . 0.0 112.761 169.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 7.1 ttm -89.26 136.78 32.83 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.516 1.126 . . . . 0.0 112.021 178.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 3.6 t -122.19 126.58 74.52 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 C-N-CA 125.906 1.682 . . . . 0.0 108.3 172.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -106.22 101.43 10.91 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.396 1.078 . . . . 0.0 109.929 178.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 13.7 m -101.28 9.52 41.66 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.673 0.789 . . . . 0.0 112.976 -179.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.87 -27.92 65.12 Favored Glycine 0 CA--C 1.54 1.646 0 O-C-N 120.912 -1.118 . . . . 0.0 114.169 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -94.13 7.09 72.75 Favored Glycine 0 CA--C 1.541 1.674 0 C-N-CA 125.527 1.537 . . . . 0.0 115.07 171.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -105.97 167.24 9.93 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.109 1.764 . . . . 0.0 112.3 -176.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -46.43 -43.33 16.37 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 126.22 1.808 . . . . 0.0 111.7 169.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 81.0 mt -60.24 -39.86 88.21 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.135 0.574 . . . . 0.0 112.44 176.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -69.65 -37.98 77.55 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 124.573 1.082 . . . . 0.0 113.784 174.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -63.77 -42.73 97.75 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 120.133 1.966 . . . . 0.0 110.897 173.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 29.6 tp -62.06 -49.08 77.42 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 126.096 1.758 . . . . 0.0 112.85 179.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -105.28 -6.85 19.33 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.707 1.203 . . . . 0.0 113.521 -171.105 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 78.66 -30.06 2.0 Favored Glycine 0 CA--C 1.54 1.643 0 O-C-N 120.254 -1.529 . . . . 0.0 113.564 -169.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.94 132.03 9.98 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 127.942 2.497 . . . . 0.0 110.414 176.629 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -144.4 35.03 1.18 Allowed 'General case' 0 N--CA 1.476 0.843 0 CA-C-O 121.901 0.858 . . . . 0.0 110.426 176.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.2 m -99.0 139.37 34.74 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.381 0.673 . . . . 0.0 111.178 179.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 53.9 p90 -163.56 177.24 8.96 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.801 1.24 . . . . 0.0 112.77 -168.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 29.8 t -128.47 141.22 51.46 Favored 'General case' 0 CA--C 1.52 -0.208 0 C-N-CA 124.37 1.068 . . . . 0.0 110.921 168.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 22.7 m -72.25 -9.95 13.45 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 177.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 43.8 pttt -77.11 -10.86 59.66 Favored 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 169.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 44.0 t0 -123.4 77.45 53.9 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 126.431 1.893 . . . . 0.0 109.615 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -70.0 -25.73 27.19 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 123.406 2.737 . . . . 0.0 114.954 -169.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 49.4 m -61.28 -53.47 62.46 Favored Pre-proline 0 N--CA 1.476 0.834 0 CA-C-N 119.867 1.212 . . . . 0.0 114.119 -177.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -66.05 -32.13 44.62 Favored 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.081 1.854 . . . . 0.0 113.011 176.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 39.1 tp -63.4 -51.49 65.57 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.63 1.172 . . . . 0.0 110.079 175.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 68.4 t80 -54.75 -45.92 74.26 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.437 1.095 . . . . 0.0 112.281 171.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -65.27 -35.81 82.17 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 114.077 1.139 . . . . 0.0 114.077 -175.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 55.1 mtm -68.85 -49.78 55.42 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 120.925 0.393 . . . . 0.0 111.401 169.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.2 mp -61.11 -29.59 69.85 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 124.805 1.242 . . . . 0.0 112.463 -179.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 13.7 ttm-85 -52.12 -28.4 17.68 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.701 1.6 . . . . 0.0 113.173 169.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -88.4 -23.41 23.34 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.496 1.518 . . . . 0.0 114.153 173.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 27.0 m120 -123.9 -22.54 4.85 Favored 'General case' 0 N--CA 1.486 1.364 0 N-CA-C 117.141 2.275 . . . . 0.0 117.141 -169.154 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 60.0 tp . . . . . 0 CA--C 1.545 0.756 0 C-N-CA 126.641 1.976 . . . . 0.0 111.588 -169.305 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.8 m . . . . . 0 N--CA 1.479 0.993 0 CA-C-O 120.719 0.295 . . . . 0.0 111.62 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 44.9 ttp180 -104.99 136.74 19.12 Favored Pre-proline 0 N--CA 1.479 0.976 0 C-N-CA 124.711 1.204 . . . . 0.0 110.994 177.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -75.99 177.93 8.1 Favored 'Trans proline' 0 CA--C 1.537 0.629 0 C-N-CA 123.171 2.581 . . . . 0.0 112.331 171.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.5 ttmt -63.0 148.26 48.21 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.686 0.794 . . . . 0.0 110.219 176.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 85.3 mt -58.17 -43.17 98.09 Favored Pre-proline 0 N--CA 1.475 0.811 0 N-CA-C 114.74 1.385 . . . . 0.0 114.74 -169.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -64.45 -27.24 62.48 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 CA-C-N 122.581 1.958 . . . . 0.0 114.04 174.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.9 tt -70.11 -38.84 75.7 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 120.914 -1.116 . . . . 0.0 110.014 171.079 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.9 tp -60.12 -38.63 83.6 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 121.264 -0.898 . . . . 0.0 111.808 170.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.403 ' HA ' ' HE2' ' A' ' 35' ' ' LYS . 8.8 mmpt? -64.05 -40.85 97.19 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.769 0.828 . . . . 0.0 112.429 173.034 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 76.0 mt -62.93 -40.31 88.44 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 124.658 1.183 . . . . 0.0 111.624 175.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 77.6 mt -64.0 -40.71 96.98 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 121.053 -1.03 . . . . 0.0 112.846 170.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 51.4 m170 -60.43 -43.99 96.23 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 119.241 0.928 . . . . 0.0 111.688 171.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -65.64 -25.57 67.42 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.504 1.121 . . . . 0.0 113.059 179.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.74 -4.42 34.4 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 123.988 0.915 . . . . 0.0 113.442 172.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.35 9.17 65.4 Favored Glycine 0 CA--C 1.536 1.367 0 C-N-CA 125.298 1.428 . . . . 0.0 114.8 -179.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -98.51 144.93 27.3 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.662 1.185 . . . . 0.0 112.277 179.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.6 tp60 -73.77 136.46 43.61 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 121.456 -0.778 . . . . 0.0 109.626 169.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -110.5 93.06 0.71 Allowed Glycine 0 CA--C 1.522 0.517 0 N-CA-C 114.317 0.487 . . . . 0.0 114.317 -172.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -146.85 73.64 1.32 Allowed 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.532 1.533 . . . . 0.0 109.939 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 25.7 mtm 65.35 134.31 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 129.77 3.228 . . . . 0.0 117.082 171.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -163.45 163.35 24.89 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 114.052 1.131 . . . . 0.0 114.052 -170.141 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 31.9 p -78.01 170.99 15.68 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.077 1.351 . . . . 0.0 112.458 172.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -53.32 -41.74 45.03 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 O-C-N 121.118 -0.989 . . . . 0.0 111.35 169.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -68.22 -42.95 79.02 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.517 1.127 . . . . 0.0 112.643 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -67.03 -39.28 86.98 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.332 0.653 . . . . 0.0 112.141 177.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 54.5 t -62.44 -46.43 96.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 123.873 0.869 . . . . 0.0 110.838 170.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.78 -37.52 86.55 Favored 'General case' 0 N--CA 1.458 -0.071 0 C-N-CA 126.243 1.817 . . . . 0.0 114.027 -175.178 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 84.4 t60 -51.62 -51.12 58.17 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 122.677 0.391 . . . . 0.0 111.498 172.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 54.5 m-85 -74.74 -33.2 62.31 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 114.522 1.304 . . . . 0.0 114.522 174.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.68 -42.79 77.33 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 120.703 1.592 . . . . 0.0 112.905 178.517 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.04 -44.0 98.38 Favored Glycine 0 CA--C 1.53 1.008 0 N-CA-C 111.548 -0.621 . . . . 0.0 111.548 173.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.7 tp60 -60.27 -42.05 94.59 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.449 1.099 . . . . 0.0 112.429 172.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 68.3 t80 -64.6 -51.66 61.57 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.837 1.255 . . . . 0.0 110.718 178.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 59.8 mt -62.09 -37.47 78.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 C-N-CA 123.855 0.862 . . . . 0.0 110.398 178.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -63.58 -47.3 82.07 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.492 1.117 . . . . 0.0 112.748 174.247 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.0 p -78.43 -28.06 14.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 124.111 0.965 . . . . 0.0 113.5 -174.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 20.9 mmtp -95.48 -12.03 26.53 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.317 1.447 . . . . 0.0 113.826 174.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 16.5 mp0 55.37 61.41 2.89 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.612 1.965 . . . . 0.0 113.632 -177.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 40.2 mt -92.77 4.53 53.63 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.543 0.737 . . . . 0.0 112.907 173.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 51.7 p90 -89.46 153.67 20.64 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.362 1.465 . . . . 0.0 110.531 169.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -79.69 122.29 26.37 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.732 -0.605 . . . . 0.0 109.381 169.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 4.6 pm0 -61.86 -34.83 76.7 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.732 1.012 . . . . 0.0 113.732 -174.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -82.86 -25.21 32.79 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.614 0.766 . . . . 0.0 111.799 -175.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -139.98 74.51 1.47 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.998 2.119 . . . . 0.0 110.682 -179.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -58.23 -14.93 8.19 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 114.697 1.369 . . . . 0.0 114.697 -178.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 21.7 p80 -67.8 -1.91 6.25 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 117.995 -1.002 . . . . 0.0 113.668 169.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 14.8 ttm -117.74 140.01 50.27 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.933 1.693 . . . . 0.0 113.284 169.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 54.8 t -115.71 142.42 28.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 127.572 2.349 . . . . 0.0 109.608 169.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -123.04 52.83 1.33 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.287 1.435 . . . . 0.0 112.135 -173.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 67.9 m -75.16 2.41 10.9 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 120.748 -1.22 . . . . 0.0 114.277 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.36 -23.64 54.06 Favored Glycine 0 CA--C 1.539 1.586 0 CA-C-N 120.155 1.343 . . . . 0.0 114.655 173.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -88.34 2.46 85.05 Favored Glycine 0 CA--C 1.54 1.651 0 C-N-CA 124.964 1.269 . . . . 0.0 115.34 171.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -111.56 -174.42 2.46 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 119.158 1.479 . . . . 0.0 113.217 -172.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -63.92 -33.9 76.74 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 120.873 -1.142 . . . . 0.0 111.759 176.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.5 tp -65.22 -38.61 90.96 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-O 121.821 0.819 . . . . 0.0 110.207 173.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -64.02 -40.63 98.37 Favored Glycine 0 CA--C 1.532 1.138 0 C-N-CA 125.074 1.321 . . . . 0.0 113.602 171.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -73.07 -29.42 62.95 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 120.248 2.024 . . . . 0.0 112.009 177.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 23.7 tp -65.57 -50.01 66.73 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.023 1.329 . . . . 0.0 111.65 172.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.45 -5.78 31.74 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 -173.604 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 77.74 -28.19 1.86 Allowed Glycine 0 CA--C 1.54 1.652 0 C-N-CA 125.502 1.525 . . . . 0.0 113.627 -170.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.3 128.83 9.22 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 127.925 2.49 . . . . 0.0 110.451 175.499 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -140.63 40.57 1.86 Allowed 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.608 1.163 . . . . 0.0 110.072 175.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 10.7 m -103.77 132.22 50.23 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 169.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 40.1 p90 -163.51 169.32 18.94 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.219 1.407 . . . . 0.0 112.384 -167.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 17.2 m -107.64 135.3 49.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 122.396 1.093 . . . . 0.0 110.95 173.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -78.16 -23.4 13.66 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 C-N-CA 125.839 1.656 . . . . 0.0 113.332 -169.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.7 pttt -79.97 -5.28 55.39 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 126.299 1.84 . . . . 0.0 115.333 179.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 42.8 t0 -116.21 86.32 17.17 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 126.373 1.869 . . . . 0.0 110.735 -170.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -61.1 -36.94 79.12 Favored 'Trans proline' 0 CA--C 1.537 0.674 0 C-N-CA 124.29 3.327 . . . . 0.0 115.423 -170.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 67.9 m -58.95 -54.91 51.72 Favored Pre-proline 0 N--CA 1.477 0.894 0 CA-C-N 119.848 1.204 . . . . 0.0 114.076 -175.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -70.05 -24.75 27.98 Favored 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 121.956 1.771 . . . . 0.0 112.97 175.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 24.0 tp -67.83 -48.94 64.81 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.323 1.049 . . . . 0.0 110.822 178.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 22.9 m-30 -62.5 -35.71 80.25 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.856 0.862 . . . . 0.0 112.572 177.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -59.88 -42.32 93.52 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.002 0.921 . . . . 0.0 112.735 178.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 35.4 mtm -72.01 -48.67 43.01 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.795 0.838 . . . . 0.0 112.521 172.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -59.13 -39.59 82.83 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-O 117.793 -1.099 . . . . 0.0 110.974 -175.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 76.6 mtt180 -54.71 -25.48 27.73 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 171.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -87.67 -24.1 24.01 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.437 1.495 . . . . 0.0 114.081 173.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -111.05 -28.38 8.34 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 114.112 1.152 . . . . 0.0 114.112 -170.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 3.2 tt . . . . . 0 CA--C 1.544 0.712 0 C-N-CA 127.587 2.355 . . . . 0.0 108.021 -177.123 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 35.7 m . . . . . 0 N--CA 1.479 0.995 0 CA-C-O 120.854 0.359 . . . . 0.0 111.548 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.8 ttp-105 -93.73 137.15 23.31 Favored Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 125.405 1.482 . . . . 0.0 111.438 178.113 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -75.81 177.98 8.01 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 124.36 3.374 . . . . 0.0 113.843 -178.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.9 ttmt -61.82 147.08 47.62 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.366 1.066 . . . . 0.0 110.549 175.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.3 mp -54.07 -48.09 95.16 Favored Pre-proline 0 N--CA 1.472 0.67 0 N-CA-C 115.016 1.487 . . . . 0.0 115.016 -168.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -60.56 -31.26 92.1 Favored 'Trans proline' 0 CA--C 1.537 0.642 0 CA-C-N 122.053 1.769 . . . . 0.0 113.796 177.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 7.5 tt -77.59 -34.7 53.49 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 120.941 -1.1 . . . . 0.0 111.381 177.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 45.1 tp -61.36 -38.53 87.28 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.697 -0.627 . . . . 0.0 111.005 169.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -66.57 -35.58 80.56 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.83 0.852 . . . . 0.0 113.042 174.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 93.5 mt -60.55 -45.48 97.08 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 CA-C-N 119.41 1.004 . . . . 0.0 111.061 169.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.1 mp -69.22 -30.79 69.03 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 121.047 -1.033 . . . . 0.0 112.864 177.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 30.1 m170 -67.39 -42.88 82.62 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.188 -0.945 . . . . 0.0 111.557 169.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.23 -25.33 68.02 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.18 0.992 . . . . 0.0 113.117 174.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.62 -9.17 53.06 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 171.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 78.65 19.99 72.27 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 125.144 1.354 . . . . 0.0 114.254 -177.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -108.23 7.62 27.47 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 116.048 1.87 . . . . 0.0 116.048 -169.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.446 ' HG2' ' H ' ' A' ' 44' ' ' GLY . 7.3 tt0 48.85 -159.43 0.05 Allowed 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 126.069 1.748 . . . . 0.0 111.211 -169.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . 0.446 ' H ' ' HG2' ' A' ' 43' ' ' GLN . . . 165.36 134.66 1.7 Allowed Glycine 0 N--CA 1.469 0.84 0 O-C-N 120.49 -1.381 . . . . 0.0 115.369 169.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -138.67 -19.99 1.03 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.794 1.238 . . . . 0.0 114.143 174.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 3.8 mtm -174.5 131.41 0.36 Allowed 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 128.0 2.52 . . . . 0.0 109.899 -178.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -163.56 152.4 14.08 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 114.569 1.322 . . . . 0.0 114.569 173.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 67.4 p -82.26 174.68 10.94 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 128.153 2.581 . . . . 0.0 112.343 174.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -53.06 -50.37 45.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 CA-C-N 119.908 1.231 . . . . 0.0 109.9 169.046 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 59.1 tptt -55.43 -37.87 68.23 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 119.043 0.838 . . . . 0.0 112.675 -176.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -80.4 -38.85 29.48 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.524 1.13 . . . . 0.0 113.265 175.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 41.9 t -68.11 -50.41 58.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 O-C-N 121.303 -0.873 . . . . 0.0 111.357 -179.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.7 mmm -68.66 -23.91 64.47 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 119.344 0.975 . . . . 0.0 112.642 -173.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -58.9 -55.6 33.07 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.657 0.783 . . . . 0.0 111.303 169.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -74.46 -32.08 62.47 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 177.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.83 -38.57 76.59 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 120.881 -1.137 . . . . 0.0 111.12 174.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.85 -42.05 99.75 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 124.194 0.902 . . . . 0.0 112.41 171.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.8 tp60 -60.37 -43.63 96.37 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.226 1.011 . . . . 0.0 112.11 171.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 61.6 t80 -60.44 -52.49 64.99 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.838 0.855 . . . . 0.0 110.788 174.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 44.0 mt -60.17 -37.04 71.75 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 124.084 0.954 . . . . 0.0 111.071 179.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -64.33 -46.6 82.79 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.372 1.069 . . . . 0.0 112.401 174.17 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.5 p -78.51 -28.52 14.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 N-CA-C 113.66 0.985 . . . . 0.0 113.66 -176.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 57.3 mmtt -91.88 -15.83 27.56 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.148 1.379 . . . . 0.0 113.731 175.038 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 14.1 mp0 54.23 73.26 0.4 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.973 2.109 . . . . 0.0 113.227 -172.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.3 tp -94.62 18.56 11.27 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.892 1.277 . . . . 0.0 112.484 178.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 51.2 p90 -127.53 160.3 31.94 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.628 1.971 . . . . 0.0 111.348 -173.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -81.34 124.74 29.62 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 121.567 -0.708 . . . . 0.0 111.176 172.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.02 -20.19 56.55 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 174.074 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -80.7 -36.69 31.9 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.732 0.813 . . . . 0.0 111.433 -176.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -149.55 92.38 1.92 Allowed 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 127.439 2.296 . . . . 0.0 109.441 -176.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 27.5 mp0 -65.59 -12.41 52.88 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 -169.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 24.3 p80 -66.01 -23.26 66.53 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 170.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 1.9 tpt -81.69 118.84 23.15 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.818 1.647 . . . . 0.0 110.498 175.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 18.2 t -104.14 130.64 54.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 125.904 1.682 . . . . 0.0 108.286 171.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 79.5 t80 -132.45 112.6 12.28 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.227 1.011 . . . . 0.0 109.686 -177.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 23.0 p -76.67 -28.98 56.17 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 114.539 1.311 . . . . 0.0 114.539 -169.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 50.87 -123.84 18.28 Favored Glycine 0 CA--C 1.539 1.567 0 CA-C-N 119.161 0.891 . . . . 0.0 112.136 -173.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -87.77 12.46 63.56 Favored Glycine 0 CA--C 1.542 1.733 0 C-N-CA 125.433 1.492 . . . . 0.0 116.214 176.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -63.12 159.38 17.55 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 119.746 1.773 . . . . 0.0 113.31 -179.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.1 mp -49.17 -37.37 22.18 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.799 1.64 . . . . 0.0 113.465 171.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 89.5 mt -59.76 -44.83 93.67 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 118.911 0.778 . . . . 0.0 111.405 175.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -73.14 -36.73 56.1 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 124.248 0.928 . . . . 0.0 113.099 176.079 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.29 -28.36 66.21 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 119.782 1.791 . . . . 0.0 112.191 178.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 42.9 tp -80.07 -54.53 5.69 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 124.289 1.036 . . . . 0.0 112.71 172.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -88.98 -7.03 56.77 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 123.846 0.858 . . . . 0.0 113.267 -172.095 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.41 -28.61 3.01 Favored Glycine 0 CA--C 1.54 1.605 0 C-N-CA 125.568 1.556 . . . . 0.0 113.001 -169.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.92 139.06 6.09 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 127.67 2.388 . . . . 0.0 111.6 -179.335 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -147.19 54.91 1.09 Allowed 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.904 1.282 . . . . 0.0 109.96 168.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 6.8 m -104.79 130.74 52.83 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-O 121.168 0.509 . . . . 0.0 109.793 169.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 54.4 p90 -168.22 177.04 5.65 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.786 1.634 . . . . 0.0 111.458 -168.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 67.2 p -121.55 143.24 49.4 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 174.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 20.5 m -71.28 -15.18 18.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 N-CA-C 113.996 1.11 . . . . 0.0 113.996 -173.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.0 pttt -77.59 -8.12 57.37 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 126.335 1.854 . . . . 0.0 114.419 172.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 44.6 t0 -119.6 78.17 21.0 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 126.142 1.777 . . . . 0.0 110.516 -177.199 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -68.56 -27.61 32.68 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 123.756 2.971 . . . . 0.0 115.288 -169.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 63.7 m -59.35 -54.39 56.62 Favored Pre-proline 0 N--CA 1.478 0.933 0 CA-C-N 120.341 1.428 . . . . 0.0 113.753 -177.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -66.46 -28.9 45.61 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 121.797 1.664 . . . . 0.0 112.585 173.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.97 -52.88 63.84 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.793 1.237 . . . . 0.0 110.631 176.006 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -66.48 -29.28 69.36 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.94 0.896 . . . . 0.0 113.379 174.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -61.76 -50.38 72.61 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.699 1.591 . . . . 0.0 112.377 174.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 36.4 mtm -65.53 -43.08 91.1 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.026 0.53 . . . . 0.0 111.595 175.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 42.8 mt -66.04 -42.27 89.8 Favored 'General case' 0 C--O 1.218 -0.578 0 CA-C-O 117.174 -1.393 . . . . 0.0 112.052 -179.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -56.02 -29.03 59.78 Favored 'General case' 0 N--CA 1.484 1.255 0 CA-C-N 121.347 1.885 . . . . 0.0 113.613 173.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -82.71 -17.6 43.85 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.518 1.527 . . . . 0.0 113.424 175.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -120.87 -15.0 8.41 Favored 'General case' 0 CA--C 1.556 1.196 0 N-CA-C 115.292 1.59 . . . . 0.0 115.292 -172.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 29.6 tp . . . . . 0 CA--C 1.545 0.75 0 C-N-CA 130.484 3.514 . . . . 0.0 108.598 -171.936 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 35.5 m . . . . . 0 N--CA 1.48 1.03 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 84.1 mtm-85 -91.75 138.63 24.92 Favored Pre-proline 0 N--CA 1.479 0.992 0 C-N-CA 124.432 1.093 . . . . 0.0 111.167 176.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -80.92 171.88 13.73 Favored 'Trans proline' 0 CA--C 1.538 0.679 0 C-N-CA 123.986 3.124 . . . . 0.0 113.038 178.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.03 149.43 15.51 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.664 0.786 . . . . 0.0 112.475 173.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 92.5 mt -59.85 -50.03 88.6 Favored Pre-proline 0 N--CA 1.476 0.875 0 N-CA-C 114.099 1.148 . . . . 0.0 114.099 -175.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -67.33 -21.34 47.65 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 121.897 1.731 . . . . 0.0 113.118 174.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.4 tt -69.66 -46.03 67.04 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 118.944 0.793 . . . . 0.0 109.826 170.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.2 tp -60.31 -31.76 70.58 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 120.865 -1.147 . . . . 0.0 112.955 176.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.62 -28.85 68.84 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 121.493 -0.754 . . . . 0.0 112.678 171.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 45.0 mt -71.03 -43.89 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 CA-C-N 119.073 0.851 . . . . 0.0 110.573 173.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.88 -38.94 87.4 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.485 0.714 . . . . 0.0 110.733 175.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 53.3 m170 -66.46 -43.83 84.44 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.426 0.69 . . . . 0.0 112.457 172.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.43 -27.99 69.67 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.945 0.898 . . . . 0.0 113.376 176.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.74 -5.22 36.29 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 124.222 1.009 . . . . 0.0 113.475 172.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.54 9.04 65.18 Favored Glycine 0 CA--C 1.537 1.456 0 C-N-CA 125.422 1.487 . . . . 0.0 115.102 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -97.96 165.67 11.81 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.752 1.221 . . . . 0.0 112.952 179.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 21.7 tm0? -118.03 145.22 44.94 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.65 1.58 . . . . 0.0 109.335 169.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -171.77 158.46 29.34 Favored Glycine 0 N--CA 1.467 0.724 0 N-CA-C 116.287 1.275 . . . . 0.0 116.287 -169.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -140.44 -63.69 0.48 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.987 1.715 . . . . 0.0 109.643 169.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 3.3 mpp? -101.63 141.7 34.1 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 127.14 2.176 . . . . 0.0 112.183 179.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 25.0 m-85 -154.41 159.78 41.28 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.369 1.067 . . . . 0.0 113.678 -175.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 71.3 p -95.21 175.02 6.77 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.353 1.461 . . . . 0.0 108.052 166.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -59.08 -40.18 80.24 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 O-C-N 120.011 -1.681 . . . . 0.0 109.981 169.148 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -59.8 -43.99 94.18 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.768 1.227 . . . . 0.0 112.756 178.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -72.67 -36.74 67.99 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 178.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 75.3 t -65.73 -51.95 56.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 CA-C-N 119.388 0.995 . . . . 0.0 110.669 171.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.4 ppp? -68.88 -26.06 64.93 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -169.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 82.8 t60 -60.18 -53.49 57.09 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 119.101 0.864 . . . . 0.0 111.27 172.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 57.3 m-85 -74.4 -30.38 61.92 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 178.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -68.64 -39.76 80.57 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.326 0.966 . . . . 0.0 112.735 172.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.52 -43.58 97.9 Favored Glycine 0 CA--C 1.532 1.132 0 CA-C-N 118.761 0.71 . . . . 0.0 111.722 172.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 36.1 tp60 -58.67 -45.35 89.61 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.104 0.961 . . . . 0.0 112.156 170.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 51.7 t80 -60.62 -51.59 68.75 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.708 0.803 . . . . 0.0 110.433 177.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 48.7 mt -59.19 -38.87 76.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 124.368 1.067 . . . . 0.0 111.039 178.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.0 tpt -64.57 -45.3 87.62 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.387 1.075 . . . . 0.0 112.726 175.05 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.1 p -78.67 -29.54 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-N 119.703 1.138 . . . . 0.0 113.716 -177.024 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 58.0 mmtt -90.74 -15.91 29.38 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.806 1.242 . . . . 0.0 113.36 175.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 14.1 mp0 50.89 73.73 0.27 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 127.182 2.193 . . . . 0.0 112.856 -172.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 11.8 tp -87.44 -4.45 59.01 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.855 0.862 . . . . 0.0 112.187 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 51.3 p90 -99.18 160.0 14.58 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.53 1.932 . . . . 0.0 111.784 177.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -91.99 134.28 34.95 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 169.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -59.6 -32.21 70.18 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -174.471 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -86.62 -20.49 27.78 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 123.795 0.838 . . . . 0.0 112.578 -169.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -140.37 63.28 1.47 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 127.985 2.514 . . . . 0.0 110.257 -178.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -60.22 -19.77 55.89 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.966 0.906 . . . . 0.0 113.254 -179.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 31.8 p80 -63.09 -7.32 5.35 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.43 1.092 . . . . 0.0 113.889 170.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 39.4 mtp -121.0 149.25 42.95 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.35 1.46 . . . . 0.0 112.926 169.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.9 p -124.1 144.37 34.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 126.075 1.75 . . . . 0.0 109.62 173.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -128.73 110.13 11.92 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.792 1.237 . . . . 0.0 110.586 -170.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 19.8 p -78.61 17.09 0.73 Allowed 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 116.723 2.12 . . . . 0.0 116.723 -168.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -53.57 113.14 2.83 Favored Glycine 0 CA--C 1.537 1.438 0 CA-C-N 119.577 1.08 . . . . 0.0 113.605 -172.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 73.6 9.34 78.28 Favored Glycine 0 CA--C 1.541 1.665 0 C-N-CA 124.979 1.276 . . . . 0.0 115.791 -177.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -86.88 158.67 19.28 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 119.355 1.577 . . . . 0.0 113.531 -175.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 27.9 mt -54.31 -37.22 64.59 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.926 1.29 . . . . 0.0 113.126 169.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.61 -42.34 96.63 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.373 -0.829 . . . . 0.0 111.347 174.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -70.49 -34.01 67.89 Favored Glycine 0 CA--C 1.532 1.109 0 CA-C-O 118.609 -1.106 . . . . 0.0 112.986 175.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -71.62 -29.24 64.45 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 120.218 2.009 . . . . 0.0 111.79 175.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 27.7 tp -71.32 -53.09 15.4 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 124.777 1.231 . . . . 0.0 112.419 174.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -102.49 -9.74 19.97 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.085 1.143 . . . . 0.0 114.085 -169.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.03 -32.89 1.97 Allowed Glycine 0 CA--C 1.54 1.625 0 C-N-CA 124.896 1.236 . . . . 0.0 112.57 -169.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.45 123.19 8.62 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 126.777 2.031 . . . . 0.0 112.553 174.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 -136.86 33.8 2.65 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.595 1.558 . . . . 0.0 111.172 177.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 11.4 m -94.14 132.37 38.74 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 169.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 49.6 p90 -162.35 172.33 15.8 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.335 1.054 . . . . 0.0 112.961 -169.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 81.6 p -116.19 136.42 53.03 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 122.452 1.12 . . . . 0.0 113.586 175.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -78.05 -17.69 13.86 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.442 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 -174.668 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.5 pttt -72.8 -8.47 55.63 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.666 1.586 . . . . 0.0 114.637 175.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -120.57 83.36 34.58 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 126.386 1.875 . . . . 0.0 110.147 -177.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -68.12 -25.2 37.74 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.862 3.041 . . . . 0.0 115.224 -169.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 62.5 m -63.52 -54.89 39.55 Favored Pre-proline 0 N--CA 1.476 0.875 0 CA-C-N 119.813 1.188 . . . . 0.0 113.87 -178.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -65.5 -30.38 52.37 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 121.827 1.685 . . . . 0.0 112.553 175.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 22.4 tp -62.61 -47.95 81.54 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.983 0.913 . . . . 0.0 111.11 174.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -59.99 -37.98 81.27 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 121.489 -0.757 . . . . 0.0 112.179 173.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -64.28 -47.26 80.22 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.043 0.937 . . . . 0.0 112.939 176.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 3.9 mtp -56.9 -44.46 82.38 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.335 1.054 . . . . 0.0 112.111 172.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.1 mp -62.53 -47.17 85.06 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.392 1.077 . . . . 0.0 110.567 176.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 14.8 mtt180 -56.98 -21.64 31.96 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.68 1.192 . . . . 0.0 114.142 171.011 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -98.57 -5.17 32.54 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 126.396 1.878 . . . . 0.0 115.01 175.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 18.9 p30 -115.88 -27.6 6.95 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 120.349 1.432 . . . . 0.0 114.479 175.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 39.8 tp . . . . . 0 CA--C 1.548 0.874 0 C-N-CA 126.565 1.946 . . . . 0.0 111.905 175.801 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 33.5 m . . . . . 0 N--CA 1.48 1.036 0 CA-C-O 121.055 0.455 . . . . 0.0 111.706 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.7 ttp-105 -87.11 133.04 39.83 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 124.693 1.197 . . . . 0.0 111.721 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -73.19 175.8 10.04 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 123.586 2.857 . . . . 0.0 112.228 173.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.5 tpmt? -61.52 147.31 45.82 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.472 0.709 . . . . 0.0 110.605 177.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -59.32 -40.63 82.05 Favored Pre-proline 0 N--CA 1.473 0.714 0 CA-C-O 117.32 -1.324 . . . . 0.0 114.239 -170.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -61.06 -33.85 91.06 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 121.994 1.796 . . . . 0.0 113.696 173.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.2 tt -70.12 -40.75 74.7 Favored 'General case' 0 CA--C 1.546 0.804 0 O-C-N 121.469 -0.769 . . . . 0.0 109.666 175.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.8 tt -63.91 -35.4 80.54 Favored 'General case' 0 N--CA 1.475 0.825 0 O-C-N 120.858 -1.151 . . . . 0.0 112.791 172.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.66 -38.91 92.15 Favored 'General case' 0 N--CA 1.48 1.026 0 O-C-N 121.216 -0.928 . . . . 0.0 112.223 170.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 91.8 mt -67.06 -38.33 81.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 123.676 0.79 . . . . 0.0 111.636 174.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 77.0 mt -61.99 -40.73 96.63 Favored 'General case' 0 CA--C 1.544 0.75 0 O-C-N 121.107 -0.996 . . . . 0.0 112.142 170.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 34.8 m170 -62.22 -42.95 99.77 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 119.332 0.969 . . . . 0.0 112.293 170.03 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.25 -25.43 68.05 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 177.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.91 -7.37 50.66 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 172.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 89.4 6.35 71.02 Favored Glycine 0 CA--C 1.537 1.449 0 C-N-CA 125.228 1.394 . . . . 0.0 114.584 -175.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -87.71 177.86 6.91 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.706 1.202 . . . . 0.0 112.263 175.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.96 149.3 43.12 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.257 1.423 . . . . 0.0 109.942 172.339 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 176.12 161.68 25.68 Favored Glycine 0 CA--C 1.527 0.802 0 N-CA-C 116.791 1.476 . . . . 0.0 116.791 170.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -125.65 8.52 7.62 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 126.018 1.727 . . . . 0.0 112.444 171.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.1 mtm -170.95 135.36 1.03 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 128.888 2.875 . . . . 0.0 109.055 -177.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -149.27 144.39 26.47 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -176.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 46.6 p -86.59 169.47 12.73 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.471 1.108 . . . . 0.0 111.304 168.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.1 t -56.16 -46.18 81.06 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 O-C-N 120.661 -1.274 . . . . 0.0 109.943 169.338 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -56.59 -35.93 68.8 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.721 0.808 . . . . 0.0 113.074 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -77.32 -46.16 23.82 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 173.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 74.8 t -63.93 -49.45 81.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 O-C-N 121.451 -0.781 . . . . 0.0 111.756 -177.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -71.24 -27.28 63.36 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 119.89 1.223 . . . . 0.0 112.287 -172.261 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -58.81 -54.45 46.95 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.345 0.658 . . . . 0.0 111.118 170.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -74.35 -32.29 62.73 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 178.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -68.05 -41.98 81.19 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 119.996 1.271 . . . . 0.0 111.823 173.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -61.36 -47.28 91.67 Favored Glycine 0 CA--C 1.527 0.81 0 CA-C-N 119.018 0.826 . . . . 0.0 111.624 173.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.3 tp60 -55.97 -47.9 76.8 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.384 1.073 . . . . 0.0 112.094 172.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -60.36 -48.79 80.25 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.121 0.968 . . . . 0.0 110.894 177.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 58.3 mt -60.85 -36.93 74.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 125.21 1.404 . . . . 0.0 111.148 178.244 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 35.3 mmt -66.34 -38.52 87.83 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.551 1.068 . . . . 0.0 113.051 171.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 82.2 t -78.31 -32.21 16.66 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 CA-C-N 119.217 0.917 . . . . 0.0 112.906 -178.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 47.2 mmtt -91.47 -15.54 28.67 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.159 1.383 . . . . 0.0 113.0 177.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.5 mp0 52.3 63.98 2.03 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.344 1.857 . . . . 0.0 113.038 -173.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 89.5 mt -92.46 18.95 7.74 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 124.432 1.093 . . . . 0.0 112.146 176.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 36.0 p90 -124.33 158.49 32.49 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 126.517 1.927 . . . . 0.0 111.005 -177.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -87.08 128.43 35.1 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.791 -0.568 . . . . 0.0 111.175 172.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -61.51 -20.72 63.52 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 172.059 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -81.78 -36.56 28.32 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.055 0.942 . . . . 0.0 111.291 -177.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -148.24 85.02 1.51 Allowed 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 127.321 2.248 . . . . 0.0 109.867 -173.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 28.3 mp0 -62.5 -15.64 51.28 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -172.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 27.3 p80 -65.88 -23.74 66.71 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 172.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.2 tpt -81.77 128.66 34.23 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.536 1.534 . . . . 0.0 110.758 175.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 3.9 t -126.16 112.39 29.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 C-N-CA 125.48 1.512 . . . . 0.0 109.4 179.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 35.9 t80 -95.46 52.25 1.37 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.875 1.27 . . . . 0.0 112.09 -170.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 55.6 m -69.69 -5.39 24.65 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 179.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.63 -25.12 58.04 Favored Glycine 0 CA--C 1.541 1.704 0 CA-C-N 120.116 1.326 . . . . 0.0 113.524 169.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -88.81 2.83 84.66 Favored Glycine 0 CA--C 1.542 1.728 0 C-N-CA 125.392 1.472 . . . . 0.0 115.295 171.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -108.93 172.99 6.52 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.174 1.79 . . . . 0.0 112.552 -177.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.8 tp -46.57 -43.05 16.84 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 126.809 2.044 . . . . 0.0 112.11 169.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 67.4 mt -54.79 -43.14 72.6 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-O 122.113 0.959 . . . . 0.0 112.159 173.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -74.64 -32.24 57.63 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 125.95 1.738 . . . . 0.0 114.412 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -67.25 -42.66 83.57 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 120.109 1.955 . . . . 0.0 110.374 169.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 24.9 tp -59.64 -50.95 71.88 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.413 1.485 . . . . 0.0 111.903 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -96.58 -13.8 22.67 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 -178.591 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.77 -18.24 12.85 Favored Glycine 0 CA--C 1.541 1.688 0 C-N-CA 125.641 1.591 . . . . 0.0 115.825 -178.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.41 17.99 1.52 Allowed 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 115.934 1.827 . . . . 0.0 115.934 -176.697 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.7 tp60 -68.05 40.73 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.045 0 N-CA-C 118.011 2.597 . . . . 0.0 118.011 -167.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 72.4 m -97.71 144.01 27.78 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 120.419 -1.426 . . . . 0.0 109.202 168.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . 0.422 ' CD1' ' HE1' ' A' ' 101' ' ' MET . 55.0 p90 -159.5 162.98 35.62 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -169.016 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 13.8 m -125.43 136.55 53.51 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.394 1.078 . . . . 0.0 110.679 177.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 20.1 m -77.42 -11.38 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -170.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -78.04 -13.88 59.71 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.875 1.27 . . . . 0.0 113.498 178.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -120.56 81.22 31.64 Favored Pre-proline 0 CA--C 1.547 0.86 0 C-N-CA 127.916 2.486 . . . . 0.0 108.874 179.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.18 -27.51 16.67 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 123.502 2.801 . . . . 0.0 114.739 -169.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 45.6 m -57.28 -51.06 84.54 Favored Pre-proline 0 N--CA 1.478 0.938 0 CA-C-N 120.342 1.428 . . . . 0.0 114.21 -178.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -67.49 -27.45 39.5 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 121.901 1.734 . . . . 0.0 113.38 175.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 21.8 tp -68.81 -42.45 77.26 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.292 1.037 . . . . 0.0 110.957 174.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -61.55 -33.79 74.45 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 118.126 -0.94 . . . . 0.0 112.675 172.395 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -62.96 -47.07 84.77 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 120.408 1.458 . . . . 0.0 112.377 176.384 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.422 ' HE1' ' CD1' ' A' ' 90' ' ' PHE . 5.7 mtm -58.78 -47.43 84.75 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.023 0.929 . . . . 0.0 111.631 172.488 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.8 mp -67.06 -38.75 86.36 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 118.033 -0.984 . . . . 0.0 112.305 -179.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 7.6 mpt_? -56.04 -24.99 42.98 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-N 120.539 1.518 . . . . 0.0 113.345 171.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -93.07 -13.62 28.35 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.057 1.743 . . . . 0.0 114.076 176.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 21.6 t30 -131.89 -20.06 2.54 Favored 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 116.579 2.066 . . . . 0.0 116.579 -173.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 48.3 tp . . . . . 0 CA--C 1.547 0.838 0 C-N-CA 126.498 1.919 . . . . 0.0 114.693 -169.079 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 18.9 m . . . . . 0 N--CA 1.481 1.103 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.3 ttp180 -90.76 130.21 41.73 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 124.876 1.27 . . . . 0.0 112.258 -174.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -70.38 176.51 7.14 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 124.09 3.194 . . . . 0.0 112.872 169.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -58.8 144.17 44.93 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.871 0.868 . . . . 0.0 109.786 173.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 86.1 mt -63.43 -38.6 41.2 Favored Pre-proline 0 N--CA 1.476 0.856 0 N-CA-C 114.697 1.369 . . . . 0.0 114.697 -169.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -62.98 -33.34 74.75 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 121.686 1.591 . . . . 0.0 113.217 170.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 8.8 tt -68.97 -45.19 71.29 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.387 0.994 . . . . 0.0 111.048 176.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.4 tt -52.33 -38.99 60.07 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.97 0.908 . . . . 0.0 111.333 169.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.59 -28.06 68.86 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.893 1.071 . . . . 0.0 113.893 176.44 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 65.2 mt -68.63 -40.41 81.73 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 CA-C-N 119.362 0.983 . . . . 0.0 110.648 171.122 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.7 mp -64.96 -37.6 88.17 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.144 -0.972 . . . . 0.0 111.005 173.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 17.9 m170 -64.09 -40.01 95.3 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.63 -0.669 . . . . 0.0 111.771 172.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.87 -29.34 70.54 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.991 0.917 . . . . 0.0 113.01 173.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.28 -2.49 22.19 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.227 1.011 . . . . 0.0 113.488 171.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.93 7.31 64.47 Favored Glycine 0 CA--C 1.536 1.361 0 C-N-CA 125.729 1.633 . . . . 0.0 114.978 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -106.56 109.45 21.37 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 118.777 1.289 . . . . 0.0 112.282 -175.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.8 tm0? -69.84 141.82 53.18 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.22 0.608 . . . . 0.0 110.149 170.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 172.01 168.17 33.13 Favored Glycine 0 N--CA 1.466 0.695 0 C-N-CA 123.595 0.617 . . . . 0.0 114.478 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -128.08 -57.91 1.23 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.389 1.476 . . . . 0.0 111.293 179.18 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 24.0 mtm -106.06 125.71 51.32 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.846 1.658 . . . . 0.0 111.876 -177.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -139.21 145.23 39.02 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.256 1.022 . . . . 0.0 113.417 -173.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 52.9 p -88.38 174.66 8.02 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 125.482 1.513 . . . . 0.0 111.848 169.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 2.6 t -56.25 -46.03 81.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 120.441 -1.412 . . . . 0.0 109.837 168.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 63.4 tttm -58.75 -40.49 84.0 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.871 0.868 . . . . 0.0 112.423 -179.154 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -74.98 -36.41 62.02 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 175.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 67.6 t -67.36 -58.35 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 CA-C-O 117.78 -1.105 . . . . 0.0 110.998 176.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 16.1 mmt -60.59 -30.53 69.87 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-N 120.744 1.611 . . . . 0.0 112.889 -173.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -54.49 -59.09 5.15 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.704 173.323 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -74.72 -32.85 62.25 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 175.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.85 -40.67 60.87 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 120.801 -1.187 . . . . 0.0 112.043 -177.328 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.48 -40.69 99.05 Favored Glycine 0 CA--C 1.529 0.913 0 N-CA-C 111.604 -0.598 . . . . 0.0 111.604 171.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.8 tp60 -60.65 -45.01 95.71 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.13 0.972 . . . . 0.0 112.07 171.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 46.4 t80 -60.42 -51.6 68.81 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.347 1.059 . . . . 0.0 110.488 176.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 45.8 mt -61.58 -37.58 78.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 C-N-CA 124.024 0.929 . . . . 0.0 110.626 179.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -67.5 -42.28 83.1 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 119.425 1.011 . . . . 0.0 113.292 175.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.8 p -78.54 -30.08 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -177.218 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 21.9 mmtp -97.2 -12.4 23.07 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 125.112 1.365 . . . . 0.0 113.889 177.067 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.0 mp0 51.82 78.4 0.12 Allowed 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 126.95 2.1 . . . . 0.0 114.343 -176.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.6 tp -95.11 2.12 55.07 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.403 1.081 . . . . 0.0 112.884 177.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -102.04 162.17 13.12 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 127.627 2.371 . . . . 0.0 110.981 174.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -92.34 132.63 36.57 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 168.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.98 -29.02 64.91 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.165 0.893 . . . . 0.0 113.101 -176.627 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -78.34 -25.59 46.46 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.466 1.106 . . . . 0.0 111.862 -174.567 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -143.96 63.7 1.33 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 127.411 2.284 . . . . 0.0 110.127 -169.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -60.55 -20.0 59.03 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.823 0.849 . . . . 0.0 113.178 179.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 6.1 p-80 -66.28 -7.4 18.41 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.195 1.398 . . . . 0.0 113.867 169.411 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.6 ttm -124.95 143.48 50.86 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.438 1.895 . . . . 0.0 111.846 174.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.0 t -129.17 141.31 46.93 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 126.535 1.934 . . . . 0.0 108.878 -174.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -122.85 71.34 1.04 Allowed 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.582 1.153 . . . . 0.0 111.394 -171.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 3.5 m -87.71 8.1 27.08 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.185 1.18 . . . . 0.0 114.185 -173.092 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.42 -27.38 63.22 Favored Glycine 0 CA--C 1.54 1.6 0 O-C-N 120.852 -1.155 . . . . 0.0 114.64 179.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -89.43 3.89 83.91 Favored Glycine 0 CA--C 1.54 1.617 0 C-N-CA 125.186 1.374 . . . . 0.0 115.172 172.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -109.28 173.22 6.42 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.97 1.708 . . . . 0.0 112.508 -175.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.1 mp -53.17 -32.93 50.37 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.765 1.626 . . . . 0.0 113.041 169.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 95.8 mt -61.08 -47.51 85.99 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.102 -0.999 . . . . 0.0 111.397 170.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -63.61 -38.28 96.02 Favored Glycine 0 CA--C 1.531 1.053 0 CA-C-O 119.064 -0.853 . . . . 0.0 113.031 173.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.16 -29.24 62.71 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 119.903 1.851 . . . . 0.0 112.951 179.676 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.4 pp -80.66 -35.19 34.17 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 175.185 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.08 -7.49 23.16 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 119.266 0.939 . . . . 0.0 113.517 -177.817 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.08 -27.04 3.16 Favored Glycine 0 CA--C 1.541 1.659 0 O-C-N 120.164 -1.585 . . . . 0.0 113.35 -169.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.27 137.47 7.12 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 128.092 2.557 . . . . 0.0 110.789 177.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -144.75 56.36 1.27 Allowed 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 119.003 0.82 . . . . 0.0 110.608 169.331 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 6.7 m -102.78 129.24 49.37 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 168.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . 0.41 ' CD2' ' HE2' ' A' ' 101' ' ' MET . 52.3 p90 -163.4 173.8 12.75 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.693 1.197 . . . . 0.0 112.857 -168.057 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 52.9 p -119.97 146.14 46.11 Favored 'General case' 0 C--N 1.333 -0.139 0 C-N-CA 123.87 0.868 . . . . 0.0 112.984 172.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 14.4 m -77.68 -14.02 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 C-N-CA 123.157 0.583 . . . . 0.0 112.435 169.562 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 22.6 ttpp -64.73 -28.61 69.7 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.357 1.863 . . . . 0.0 112.598 169.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -117.55 77.47 10.72 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 126.46 1.904 . . . . 0.0 110.003 177.044 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -69.78 -24.78 29.18 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 123.613 2.875 . . . . 0.0 115.023 -169.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 48.8 m -60.4 -52.75 70.73 Favored Pre-proline 0 N--CA 1.477 0.886 0 CA-C-N 120.11 1.323 . . . . 0.0 114.124 -177.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -64.54 -32.33 59.18 Favored 'Trans proline' 0 CA--C 1.539 0.765 0 C-N-CA 122.109 1.872 . . . . 0.0 113.081 175.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 19.6 tp -65.38 -43.39 90.86 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 121.247 -0.908 . . . . 0.0 111.046 173.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -63.85 -37.4 87.26 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.745 0.818 . . . . 0.0 112.223 174.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -62.71 -47.51 83.28 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.836 0.854 . . . . 0.0 112.655 174.419 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.41 ' HE2' ' CD2' ' A' ' 90' ' ' PHE . 32.0 mtm -58.99 -46.72 87.44 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.211 0.604 . . . . 0.0 112.223 171.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 59.0 mt -58.55 -47.18 85.07 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.064 0.946 . . . . 0.0 111.821 177.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 34.9 mtp180 -54.46 -25.11 23.22 Favored 'General case' 0 N--CA 1.482 1.168 0 CA-C-N 119.768 1.167 . . . . 0.0 113.535 173.059 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -91.55 -15.41 28.74 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 126.259 1.823 . . . . 0.0 114.655 176.331 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 14.6 p30 -116.29 -23.14 8.5 Favored 'General case' 0 N--CA 1.483 1.225 0 CA-C-N 120.485 1.493 . . . . 0.0 114.587 179.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 30.0 tp . . . . . 0 CA--C 1.537 0.45 0 C-N-CA 128.405 2.682 . . . . 0.0 106.101 169.624 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 31.7 m . . . . . 0 N--CA 1.482 1.138 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 95.4 mtm-85 -86.18 149.42 49.88 Favored Pre-proline 0 N--CA 1.48 1.037 0 O-C-N 121.004 -1.06 . . . . 0.0 111.217 -177.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -73.19 174.65 11.71 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 123.155 2.57 . . . . 0.0 111.823 169.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt -62.94 148.46 47.4 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.406 1.082 . . . . 0.0 110.054 177.112 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 94.0 mt -55.74 -46.73 99.7 Favored Pre-proline 0 N--CA 1.476 0.832 0 N-CA-C 115.24 1.57 . . . . 0.0 115.24 -168.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -66.4 -23.54 50.95 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 CA-C-N 122.509 1.932 . . . . 0.0 114.247 175.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.3 tt -71.78 -39.97 69.57 Favored 'General case' 0 N--CA 1.474 0.725 0 O-C-N 120.85 -1.156 . . . . 0.0 109.932 170.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 13.6 tp -61.58 -34.58 75.86 Favored 'General case' 0 CA--C 1.548 0.895 0 O-C-N 121.12 -0.987 . . . . 0.0 111.665 170.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.405 ' HA ' ' HE2' ' A' ' 35' ' ' LYS . 8.5 mmpt? -65.43 -39.34 91.97 Favored 'General case' 0 N--CA 1.481 1.095 0 O-C-N 121.147 -0.971 . . . . 0.0 112.649 170.012 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 52.6 mt -63.57 -38.88 83.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 124.401 1.08 . . . . 0.0 111.844 172.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.9 mt -61.52 -41.04 96.72 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 121.058 -1.026 . . . . 0.0 112.235 169.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 49.4 m170 -64.68 -41.93 95.7 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 121.494 -0.754 . . . . 0.0 112.209 172.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.91 -25.0 67.7 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.774 1.23 . . . . 0.0 113.331 177.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.44 -6.5 40.84 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.904 0.881 . . . . 0.0 113.313 171.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.03 12.73 59.9 Favored Glycine 0 CA--C 1.536 1.388 0 C-N-CA 125.177 1.37 . . . . 0.0 114.453 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -108.92 163.16 13.53 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.533 1.533 . . . . 0.0 112.813 -178.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -79.99 172.54 13.63 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 121.63 -0.669 . . . . 0.0 110.934 168.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -153.44 102.44 0.22 Allowed Glycine 0 N--CA 1.469 0.841 0 O-C-N 121.373 -0.829 . . . . 0.0 114.252 177.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -150.12 85.62 1.41 Allowed 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 126.805 2.042 . . . . 0.0 107.384 170.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.1 mpp? 67.22 135.46 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 131.49 3.916 . . . . 0.0 116.256 176.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -161.76 169.34 21.59 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.138 1.375 . . . . 0.0 112.788 177.309 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 82.1 p -91.09 171.65 9.11 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 126.55 1.94 . . . . 0.0 111.954 172.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -51.19 -42.23 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.317 0 O-C-N 121.288 -0.883 . . . . 0.0 111.537 172.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -62.57 -48.19 80.53 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.367 1.067 . . . . 0.0 112.544 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -73.64 -31.56 63.57 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -178.475 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 57.9 t -64.91 -46.31 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 O-C-N 121.615 -0.678 . . . . 0.0 110.647 169.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.9 ttm -69.29 -32.67 71.98 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 126.2 1.8 . . . . 0.0 114.114 -177.345 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -51.48 -49.7 61.3 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 122.974 0.51 . . . . 0.0 111.137 169.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 42.3 m-85 -74.71 -36.7 62.69 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 115.04 1.496 . . . . 0.0 115.04 171.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.1 mp -71.77 -36.95 70.52 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 120.87 1.668 . . . . 0.0 113.435 -177.42 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.13 -42.1 99.56 Favored Glycine 0 CA--C 1.533 1.18 0 CA-C-N 119.246 0.93 . . . . 0.0 111.688 170.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.9 tp60 -62.14 -42.69 99.5 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.644 1.178 . . . . 0.0 112.317 172.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 50.4 t80 -62.17 -52.34 64.2 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.743 1.217 . . . . 0.0 110.2 176.432 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 69.0 mt -58.68 -39.61 76.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 C-N-CA 123.954 0.902 . . . . 0.0 110.752 178.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.3 tpt -65.8 -44.19 86.41 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.351 1.06 . . . . 0.0 112.902 175.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.0 p -78.49 -27.77 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 CA-C-N 119.809 1.186 . . . . 0.0 113.399 -177.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 54.4 mmtt -89.73 -15.74 31.83 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.108 1.363 . . . . 0.0 113.268 173.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 13.9 mp0 51.86 57.88 6.05 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.815 2.046 . . . . 0.0 112.268 -171.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 13.8 tp -91.88 0.93 57.46 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.393 1.077 . . . . 0.0 112.533 -174.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 41.5 p90 -92.62 156.43 17.1 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.854 1.662 . . . . 0.0 111.177 171.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -80.41 122.71 27.3 Favored 'General case' 0 CA--C 1.541 0.634 0 O-C-N 121.579 -0.7 . . . . 0.0 110.86 172.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -59.53 -23.85 63.18 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 114.683 1.364 . . . . 0.0 114.683 177.842 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -91.35 -27.81 18.12 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 123.96 0.904 . . . . 0.0 112.154 -173.443 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -147.03 87.73 1.7 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.844 2.457 . . . . 0.0 109.605 178.328 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 29.6 mp0 -64.43 -12.03 39.22 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 -169.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 28.1 p80 -65.66 -24.79 67.11 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 170.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 20.6 tpp -86.14 132.02 34.12 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.239 1.416 . . . . 0.0 111.629 177.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 3.7 t -127.09 125.71 66.85 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 C-N-CA 127.01 2.124 . . . . 0.0 109.49 178.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 23.2 t80 -101.14 46.84 0.93 Allowed 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.64 1.176 . . . . 0.0 113.244 -169.626 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 85.2 m -64.88 -9.65 22.58 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 120.467 -1.396 . . . . 0.0 113.848 -179.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -54.98 -22.79 29.13 Favored Glycine 0 CA--C 1.541 1.687 0 C-N-CA 124.78 1.181 . . . . 0.0 113.776 169.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -86.72 1.98 87.15 Favored Glycine 0 CA--C 1.541 1.71 0 C-N-CA 125.228 1.394 . . . . 0.0 116.148 173.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -131.69 -173.62 3.18 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 120.1 1.95 . . . . 0.0 113.769 -175.217 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 7.5 mp -47.15 -40.52 15.89 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.949 1.699 . . . . 0.0 113.532 179.081 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.5 tp -68.57 -32.4 72.29 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-O 121.617 0.722 . . . . 0.0 111.256 178.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -73.15 -36.0 56.74 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 126.64 2.067 . . . . 0.0 114.51 173.442 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -66.37 -42.36 88.09 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.861 1.83 . . . . 0.0 110.161 170.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 27.7 tp -59.25 -51.45 69.93 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.677 1.191 . . . . 0.0 112.332 178.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.22 -10.98 26.74 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 114.91 1.448 . . . . 0.0 114.91 -177.303 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.0 -20.04 7.06 Favored Glycine 0 CA--C 1.539 1.584 0 C-N-CA 125.931 1.729 . . . . 0.0 115.638 -179.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.09 30.57 0.49 Allowed 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -175.207 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 5.6 tp60 -70.45 44.79 0.08 Allowed 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 116.4 2.0 . . . . 0.0 116.4 -168.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 21.2 m -105.61 138.36 41.94 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 120.778 -1.201 . . . . 0.0 108.973 169.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . 0.405 ' CG ' ' HE3' ' A' ' 101' ' ' MET . 45.7 p90 -157.24 167.94 28.87 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 -167.528 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 50.1 m -115.09 136.02 53.57 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 113.936 -1.484 . . . . 0.0 109.841 175.3 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 24.4 m -77.53 -20.05 14.05 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.344 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -178.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -74.8 -6.25 47.94 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 126.484 1.913 . . . . 0.0 115.171 -178.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -121.16 87.89 44.66 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 126.439 1.896 . . . . 0.0 109.476 -177.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -63.33 -31.34 73.35 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 123.93 3.086 . . . . 0.0 115.273 -169.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 70.0 m -61.5 -55.91 38.34 Favored Pre-proline 0 N--CA 1.477 0.89 0 CA-C-N 120.12 1.327 . . . . 0.0 113.825 -177.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -67.17 -27.17 41.81 Favored 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 121.817 1.678 . . . . 0.0 112.63 175.219 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 27.9 tp -65.55 -45.93 81.5 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.634 0.774 . . . . 0.0 111.158 175.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -63.48 -36.33 83.4 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.627 -0.671 . . . . 0.0 112.564 173.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -59.92 -46.3 89.8 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 119.355 0.98 . . . . 0.0 112.079 176.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.405 ' HE3' ' CG ' ' A' ' 90' ' ' PHE . 29.0 mtm -62.09 -49.86 74.25 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 171.637 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -64.94 -46.76 80.23 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 118.042 -0.98 . . . . 0.0 111.053 -171.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -58.19 -23.6 56.11 Favored 'General case' 0 N--CA 1.482 1.14 0 CA-C-N 119.975 1.261 . . . . 0.0 113.338 175.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -90.49 -18.74 24.78 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.968 1.707 . . . . 0.0 114.806 174.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -121.86 -26.68 4.78 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-N 119.843 1.201 . . . . 0.0 114.145 -171.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 3.3 tt . . . . . 0 CA--C 1.543 0.676 0 C-N-CA 127.631 2.373 . . . . 0.0 107.188 174.703 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 17.8 m . . . . . 0 N--CA 1.481 1.093 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 30.9 ttm105 -86.69 143.1 35.26 Favored Pre-proline 0 N--CA 1.48 1.075 0 C-N-CA 124.796 1.238 . . . . 0.0 112.56 -172.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -65.81 166.83 19.09 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 122.606 2.204 . . . . 0.0 111.953 168.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 27.8 ttpt -72.53 157.67 37.15 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 170.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.3 mp -50.4 -47.5 83.27 Favored Pre-proline 0 N--CA 1.473 0.696 0 N-CA-C 115.252 1.575 . . . . 0.0 115.252 -168.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_exo -66.19 -28.99 47.79 Favored 'Trans proline' 0 C--N 1.348 0.522 0 CA-C-N 121.689 1.639 . . . . 0.0 113.732 178.414 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.4 tt -74.11 -38.62 63.77 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.37 -0.831 . . . . 0.0 109.606 177.266 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 23.1 tp -60.2 -35.59 75.75 Favored 'General case' 0 CA--C 1.55 0.956 0 O-C-N 121.521 -0.737 . . . . 0.0 111.341 170.115 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.4 mmtp -69.62 -36.51 76.21 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 121.386 -0.821 . . . . 0.0 112.552 174.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.29 -38.65 81.66 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.495 0.718 . . . . 0.0 110.921 170.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.5 mp -64.13 -39.95 95.14 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.029 -1.045 . . . . 0.0 113.116 171.155 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 35.6 m170 -58.81 -47.32 85.17 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 119.592 1.087 . . . . 0.0 111.497 170.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.16 -25.15 68.22 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 177.098 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.62 -15.22 63.54 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.067 0.947 . . . . 0.0 113.322 172.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 89.47 12.59 62.68 Favored Glycine 0 CA--C 1.537 1.413 0 C-N-CA 125.06 1.314 . . . . 0.0 113.883 -169.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -98.67 157.5 16.22 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.893 1.277 . . . . 0.0 111.662 176.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.8 tp60 -80.38 164.42 23.11 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.658 0.783 . . . . 0.0 111.36 174.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -82.08 -156.78 18.86 Favored Glycine 0 CA--C 1.537 1.462 0 N-CA-C 115.809 1.084 . . . . 0.0 115.809 174.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 61.0 66.16 0.93 Allowed 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 127.611 2.364 . . . . 0.0 116.592 173.39 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . 0.401 0.9 OUTLIER 51.38 146.05 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.275 1 N-CA-C 121.967 4.062 . . . . 0.0 121.967 168.307 . . . . . . . . 4 3 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -157.53 172.15 19.08 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.559 1.543 . . . . 0.0 112.596 -168.416 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 40.0 p -81.66 168.78 17.77 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 124.475 1.11 . . . . 0.0 112.067 171.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -57.92 -41.06 79.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 120.22 -1.55 . . . . 0.0 110.663 172.406 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -59.42 -31.77 69.58 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.666 0.786 . . . . 0.0 112.709 178.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -80.55 -53.16 6.81 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.082 0.953 . . . . 0.0 112.903 170.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 88.5 t -56.08 -52.3 51.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 123.776 0.83 . . . . 0.0 111.275 -176.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' MET . . . . . 0.411 ' HA ' ' HE3' ' A' ' 53' ' ' MET . 26.7 mmm -73.15 -30.64 63.73 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -172.399 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 54.9 t-80 -61.58 -48.24 81.83 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.583 170.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -64.54 -38.95 92.79 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 121.743 -0.598 . . . . 0.0 112.389 173.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.98 -38.78 92.11 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 121.187 -0.946 . . . . 0.0 111.448 175.055 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.74 -39.14 97.17 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 125.385 1.469 . . . . 0.0 112.885 172.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 11.9 tp60 -60.94 -48.64 80.87 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.757 1.223 . . . . 0.0 111.091 169.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -56.54 -48.96 76.17 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.122 -0.986 . . . . 0.0 110.735 174.218 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 47.0 mt -59.63 -36.76 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 125.228 1.411 . . . . 0.0 111.935 177.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.5 tpt -68.12 -36.5 79.84 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.718 1.207 . . . . 0.0 112.231 174.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 94.2 t -78.18 -33.41 17.84 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 124.063 0.945 . . . . 0.0 112.677 178.458 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 48.2 mmtt -89.84 -14.82 33.56 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.752 1.221 . . . . 0.0 113.222 178.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.6 mp0 50.02 63.94 1.99 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 127.627 2.371 . . . . 0.0 113.088 -171.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 14.3 tp -91.26 -1.59 57.64 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.149 0.98 . . . . 0.0 113.295 -175.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 55.1 p90 -90.25 156.22 18.45 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.551 1.54 . . . . 0.0 111.923 178.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -76.83 128.64 34.97 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.816 -0.553 . . . . 0.0 111.136 171.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.6 pm0 -69.68 -27.22 64.83 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 115.271 1.582 . . . . 0.0 115.271 -171.171 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -96.08 -26.92 15.32 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 119.165 0.893 . . . . 0.0 111.891 -177.315 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -136.19 79.75 1.79 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.669 1.988 . . . . 0.0 111.178 176.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 29.7 mp0 -60.89 -12.73 12.0 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -173.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 23.9 p80 -62.38 -25.76 68.1 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 118.94 0.791 . . . . 0.0 112.786 170.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 18.2 tpp -83.6 129.17 34.96 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.069 1.347 . . . . 0.0 110.955 172.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.4 t -119.01 117.57 54.73 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 125.991 1.716 . . . . 0.0 107.856 174.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -102.09 65.74 0.99 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.213 1.005 . . . . 0.0 112.165 -169.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 2.7 m -79.32 3.91 16.77 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 114.258 1.207 . . . . 0.0 114.258 -173.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.95 -26.08 54.48 Favored Glycine 0 CA--C 1.542 1.727 0 CA-C-N 119.927 1.24 . . . . 0.0 114.316 171.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -91.68 7.34 79.68 Favored Glycine 0 CA--C 1.542 1.738 0 C-N-CA 125.437 1.494 . . . . 0.0 115.374 172.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -112.74 170.31 8.28 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.181 1.792 . . . . 0.0 112.537 -174.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.9 tt -46.53 -43.17 16.72 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.63 1.572 . . . . 0.0 111.089 169.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 96.3 mt -55.13 -43.23 73.93 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.248 1.019 . . . . 0.0 112.522 173.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -70.64 -39.1 67.61 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 124.984 1.278 . . . . 0.0 113.62 177.275 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -63.52 -42.61 98.46 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 120.363 2.082 . . . . 0.0 110.696 174.074 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 40.2 tp -62.7 -51.59 66.6 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.976 1.711 . . . . 0.0 112.52 -178.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -97.26 -8.48 29.73 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 -176.251 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 82.69 -24.68 4.94 Favored Glycine 0 CA--C 1.54 1.613 0 C-N-CA 125.492 1.52 . . . . 0.0 113.126 -169.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.18 137.21 10.39 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 127.049 2.14 . . . . 0.0 111.611 175.588 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -148.44 45.1 1.04 Allowed 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.153 0.981 . . . . 0.0 110.161 169.05 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 11.5 m -99.51 131.17 45.69 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 120.933 -1.104 . . . . 0.0 110.368 170.115 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 35.7 p90 -165.16 178.78 6.74 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.589 1.555 . . . . 0.0 111.98 -168.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 77.3 p -127.21 143.88 51.16 Favored 'General case' 0 N--CA 1.456 -0.162 0 N-CA-C 114.63 1.345 . . . . 0.0 114.63 174.157 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.3 m -72.1 -16.84 18.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 N-CA-C 114.042 1.127 . . . . 0.0 114.042 -173.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.5 pttt -74.43 -9.49 58.64 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.854 1.662 . . . . 0.0 114.108 172.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -121.09 79.84 34.59 Favored Pre-proline 0 CA--C 1.549 0.906 0 C-N-CA 126.091 1.757 . . . . 0.0 110.154 -179.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.14 -28.52 28.11 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 123.449 2.766 . . . . 0.0 114.712 -169.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 59.2 m -57.51 -54.14 58.17 Favored Pre-proline 0 N--CA 1.477 0.882 0 CA-C-N 120.147 1.339 . . . . 0.0 113.721 -177.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -66.16 -27.26 49.17 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 121.889 1.726 . . . . 0.0 112.854 174.323 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.21 -53.41 57.31 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.255 1.022 . . . . 0.0 110.568 175.295 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -63.77 -32.45 73.96 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.72 0.808 . . . . 0.0 112.52 173.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -62.47 -43.85 97.81 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 120.123 1.329 . . . . 0.0 112.844 175.116 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 23.5 mtm -63.5 -49.67 72.64 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.023 0.529 . . . . 0.0 111.729 171.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.8 mp -62.43 -36.78 83.46 Favored 'General case' 0 C--O 1.219 -0.547 0 CA-C-O 117.696 -1.145 . . . . 0.0 111.808 -177.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 -55.1 -24.49 25.9 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 121.336 1.88 . . . . 0.0 113.662 171.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -89.99 -15.08 32.65 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 125.367 1.467 . . . . 0.0 114.559 173.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -132.37 2.69 3.88 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 115.595 1.702 . . . . 0.0 115.595 -177.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 62.0 tp . . . . . 0 CA--C 1.54 0.577 0 C-N-CA 128.251 2.62 . . . . 0.0 108.573 -178.705 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.6 m . . . . . 0 N--CA 1.48 1.033 0 CA-C-O 121.173 0.511 . . . . 0.0 111.84 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -81.8 140.91 47.34 Favored Pre-proline 0 N--CA 1.481 1.121 0 C-N-CA 124.547 1.139 . . . . 0.0 112.941 -169.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -70.28 175.6 8.31 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 123.793 2.995 . . . . 0.0 113.791 175.003 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 17.3 ttmt -60.56 147.27 42.14 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.564 1.145 . . . . 0.0 109.617 172.253 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 73.6 mt -57.12 -47.05 99.73 Favored Pre-proline 0 N--CA 1.474 0.744 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 -167.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -66.82 -23.63 47.71 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 CA-C-N 121.8 1.679 . . . . 0.0 114.609 176.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 5.6 tt -65.92 -44.11 86.12 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 120.057 1.299 . . . . 0.0 109.31 172.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 36.6 tp -62.13 -39.99 94.42 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 121.738 -0.601 . . . . 0.0 111.729 172.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.8 mmpt? -61.28 -39.81 91.81 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.339 0.655 . . . . 0.0 112.698 174.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 63.5 mt -64.33 -35.56 74.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 124.355 1.062 . . . . 0.0 112.224 174.402 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.1 mt -70.65 -34.87 72.51 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 119.666 1.121 . . . . 0.0 111.944 171.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 50.9 m170 -61.19 -42.32 98.36 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.053 0.842 . . . . 0.0 111.275 169.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.66 -24.86 67.72 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.512 1.125 . . . . 0.0 113.513 175.023 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.51 -7.02 44.91 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 124.155 0.982 . . . . 0.0 113.141 171.284 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 85.49 12.78 71.92 Favored Glycine 0 CA--C 1.537 1.421 0 C-N-CA 125.205 1.383 . . . . 0.0 114.146 -173.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -106.3 140.9 38.51 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.955 1.302 . . . . 0.0 112.637 -176.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -76.66 162.55 27.64 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 121.721 -0.612 . . . . 0.0 110.479 169.036 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -162.99 130.42 2.24 Favored Glycine 0 CA--C 1.526 0.747 0 O-C-N 121.432 -0.792 . . . . 0.0 114.982 -178.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -142.17 66.68 1.33 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 126.227 1.811 . . . . 0.0 109.162 173.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . 0.419 0.6 OUTLIER 63.38 145.86 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 129.537 3.135 . . . . 0.0 118.191 -175.013 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -162.72 169.55 19.81 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.089 1.756 . . . . 0.0 113.07 -168.745 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 41.8 p -79.96 171.37 15.19 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 125.244 1.418 . . . . 0.0 112.01 169.5 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -59.52 -39.19 78.68 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 O-C-N 120.549 -1.345 . . . . 0.0 111.676 173.736 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -62.18 -45.57 92.82 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.272 1.429 . . . . 0.0 112.724 176.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -68.76 -38.88 80.42 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.259 0.624 . . . . 0.0 112.176 176.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 8.5 t -58.37 -45.3 89.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 124.689 1.196 . . . . 0.0 111.126 170.177 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -69.3 -33.97 73.98 Favored 'General case' 0 CA--C 1.519 -0.242 0 C-N-CA 126.942 2.097 . . . . 0.0 114.512 -172.425 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -51.56 -49.29 62.32 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 120.699 0.285 . . . . 0.0 111.149 169.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -74.77 -32.26 62.01 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 172.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.91 -40.79 78.89 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 120.431 1.469 . . . . 0.0 112.43 178.873 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -60.18 -45.62 95.71 Favored Glycine 0 CA--C 1.529 0.919 0 N-CA-C 111.269 -0.732 . . . . 0.0 111.269 171.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 11.0 tp60 -58.32 -42.61 87.12 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.269 1.028 . . . . 0.0 112.582 173.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -61.13 -50.12 74.48 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.078 0.951 . . . . 0.0 110.544 174.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 72.4 mt -61.44 -37.13 77.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 123.781 0.833 . . . . 0.0 111.154 178.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 34.3 mmt -67.58 -42.97 81.65 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 119.502 1.046 . . . . 0.0 113.256 174.183 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.3 p -78.49 -27.42 14.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 CA-C-N 119.738 1.154 . . . . 0.0 113.267 -176.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 56.4 mmtt -93.24 -15.69 25.6 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.266 1.427 . . . . 0.0 113.566 174.134 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 14.8 mp0 54.36 61.29 3.09 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.68 1.992 . . . . 0.0 113.022 -175.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.2 tp -94.4 10.12 35.6 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.48 1.112 . . . . 0.0 112.873 -176.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 25.1 p90 -113.26 155.43 25.1 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 127.128 2.171 . . . . 0.0 111.49 -178.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -80.96 129.64 34.63 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 122.048 -0.408 . . . . 0.0 110.174 169.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 7.7 pm0 -59.02 -33.88 71.24 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -173.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -108.02 -27.88 9.88 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.498 1.119 . . . . 0.0 112.185 -171.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -109.14 56.5 0.62 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.763 2.025 . . . . 0.0 111.019 171.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -60.71 -18.63 55.43 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 124.494 1.118 . . . . 0.0 113.434 -175.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 29.6 p80 -63.26 -14.8 53.56 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.584 1.154 . . . . 0.0 114.013 171.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 13.8 ttm -111.64 141.72 44.87 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.007 1.323 . . . . 0.0 112.132 172.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.5 t -122.99 133.3 69.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 126.258 1.823 . . . . 0.0 108.821 175.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 6.6 t80 -113.32 52.07 0.81 Allowed 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.77 0.795 . . . . 0.0 112.968 -169.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 4.9 m -71.52 -6.37 40.12 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 -175.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -55.54 -25.54 42.69 Favored Glycine 0 CA--C 1.541 1.657 0 C-N-CA 125.439 1.495 . . . . 0.0 115.148 177.165 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -88.47 0.24 82.95 Favored Glycine 0 CA--C 1.541 1.658 0 C-N-CA 125.051 1.31 . . . . 0.0 115.601 175.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -131.92 -176.07 3.93 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 126.067 1.747 . . . . 0.0 112.072 -171.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -46.71 -47.05 20.55 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.833 2.053 . . . . 0.0 113.871 -170.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 94.0 mt -60.08 -37.81 81.03 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.81 1.244 . . . . 0.0 112.564 175.162 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -73.16 -34.24 58.42 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 125.697 1.617 . . . . 0.0 114.311 175.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -66.51 -42.39 87.42 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 119.68 1.74 . . . . 0.0 110.444 171.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 32.9 tp -61.53 -50.77 71.33 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.401 1.48 . . . . 0.0 112.524 179.049 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -99.02 -14.27 19.53 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 115.154 1.538 . . . . 0.0 115.154 -175.442 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 82.35 -19.1 11.37 Favored Glycine 0 CA--C 1.541 1.665 0 C-N-CA 125.729 1.633 . . . . 0.0 116.114 179.448 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.0 24.12 1.18 Allowed 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 -176.794 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -71.26 52.65 0.18 Allowed 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 117.533 2.42 . . . . 0.0 117.533 -167.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 36.0 m -117.79 139.06 51.6 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.235 1.014 . . . . 0.0 108.53 168.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 45.8 p90 -159.34 167.12 29.66 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -167.245 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 2.1 m -99.91 136.29 40.05 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.608 1.563 . . . . 0.0 110.328 169.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 6.9 m -77.6 -19.87 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 124.399 1.079 . . . . 0.0 112.803 175.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 61.3 pttt -80.56 -2.94 48.38 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 127.592 2.357 . . . . 0.0 115.114 -179.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -125.94 94.26 42.17 Favored Pre-proline 0 CA--C 1.549 0.92 0 C-N-CA 126.592 1.957 . . . . 0.0 110.267 -171.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -61.5 -31.39 87.66 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 123.936 3.091 . . . . 0.0 115.529 -174.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 66.8 m -58.53 -53.1 69.65 Favored Pre-proline 0 N--CA 1.477 0.882 0 CA-C-N 119.92 1.236 . . . . 0.0 114.057 -178.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -68.39 -24.33 36.99 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 122.034 1.823 . . . . 0.0 113.49 174.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 61.5 mt -65.9 -47.08 75.99 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 119.522 1.055 . . . . 0.0 111.058 174.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -58.13 -41.3 83.36 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 178.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -58.74 -51.72 68.77 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 118.963 0.801 . . . . 0.0 112.487 176.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 34.0 mtm -64.16 -49.69 71.09 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.266 0.626 . . . . 0.0 112.287 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.4 mp -63.61 -49.38 73.54 Favored 'General case' 0 C--O 1.224 -0.263 0 C-N-CA 124.568 1.147 . . . . 0.0 110.756 -176.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -60.32 -19.21 54.39 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 120.238 1.381 . . . . 0.0 113.647 178.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -96.74 -14.14 22.21 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.948 1.699 . . . . 0.0 114.435 175.126 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -118.23 -21.39 8.19 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-N 120.047 1.294 . . . . 0.0 113.742 -178.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 43.8 tp . . . . . 0 CA--C 1.536 0.439 0 C-N-CA 127.225 2.21 . . . . 0.0 107.787 169.26 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 35.0 m . . . . . 0 N--CA 1.477 0.914 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 37.6 mtm180 -91.39 145.25 31.04 Favored Pre-proline 0 N--CA 1.479 1.01 0 C-N-CA 124.405 1.082 . . . . 0.0 112.482 -175.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -75.78 177.92 8.09 Favored 'Trans proline' 0 CA--C 1.54 0.807 0 C-N-CA 124.152 3.235 . . . . 0.0 111.499 169.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.7 ttmt -69.24 148.53 49.68 Favored 'General case' 0 CA--C 1.536 0.442 0 O-C-N 121.638 -0.664 . . . . 0.0 111.237 178.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 10.0 mp -53.67 -55.17 38.17 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 125.133 1.373 . . . . 0.0 114.548 -169.236 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -65.46 -22.0 59.7 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 122.297 1.998 . . . . 0.0 113.845 175.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.0 tt -75.21 -32.41 61.18 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 119.88 1.218 . . . . 0.0 110.988 172.573 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.3 tp -63.69 -37.31 86.88 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.308 -0.87 . . . . 0.0 111.017 169.189 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 8.9 mmpt? -62.61 -37.62 86.96 Favored 'General case' 0 N--CA 1.479 0.998 0 O-C-N 121.674 -0.641 . . . . 0.0 112.34 173.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 90.4 mt -62.94 -39.0 83.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 124.067 0.947 . . . . 0.0 111.467 172.507 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.3 mp -70.35 -33.06 71.01 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 120.715 -1.241 . . . . 0.0 113.332 172.175 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 63.5 m170 -64.46 -41.36 96.56 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 120.957 -1.09 . . . . 0.0 111.401 170.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.28 -24.12 67.72 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.013 0.925 . . . . 0.0 113.323 172.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.09 -9.12 57.97 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 123.955 0.902 . . . . 0.0 113.425 172.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.51 7.75 64.75 Favored Glycine 0 CA--C 1.538 1.491 0 C-N-CA 125.4 1.476 . . . . 0.0 114.572 -175.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -94.08 166.54 12.08 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.67 1.188 . . . . 0.0 113.08 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.1 tm0? -126.53 144.53 50.84 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.839 1.656 . . . . 0.0 108.973 169.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -174.71 165.48 36.79 Favored Glycine 0 C--N 1.339 0.711 0 N-CA-C 116.496 1.358 . . . . 0.0 116.496 -170.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -141.26 -65.38 0.43 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.408 1.883 . . . . 0.0 109.18 169.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 25.9 mtm -106.29 142.76 35.43 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 127.811 2.445 . . . . 0.0 112.169 -178.069 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -157.4 162.95 39.03 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.062 0.945 . . . . 0.0 113.419 -173.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 81.2 p -94.97 172.85 7.9 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.613 1.165 . . . . 0.0 108.366 166.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -57.4 -46.88 85.62 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.426 0 O-C-N 120.082 -1.636 . . . . 0.0 109.817 169.45 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -55.97 -39.89 72.45 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.786 1.234 . . . . 0.0 112.649 -179.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -74.2 -37.29 63.93 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 175.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 97.0 t -68.71 -49.66 62.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 CA-C-N 119.946 1.248 . . . . 0.0 111.978 175.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' MET . . . . . 0.415 ' HA ' ' HE3' ' A' ' 53' ' ' MET . 11.5 mmm -67.63 -28.05 67.4 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 119.229 0.922 . . . . 0.0 112.99 -170.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -53.44 -54.03 42.77 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 114.84 -1.073 . . . . 0.0 111.355 169.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -74.35 -35.22 63.57 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 176.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.32 -37.56 77.79 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 121.131 -0.98 . . . . 0.0 112.107 178.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -64.99 -42.82 96.6 Favored Glycine 0 CA--C 1.529 0.929 0 C-N-CA 124.588 1.09 . . . . 0.0 112.054 172.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 30.4 tp60 -57.94 -44.54 87.01 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.046 0.938 . . . . 0.0 111.641 169.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 70.9 t80 -60.86 -52.18 66.13 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.505 0.722 . . . . 0.0 111.304 176.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 25.8 mt -58.79 -36.83 62.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 124.376 1.07 . . . . 0.0 111.371 177.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.6 tpt -66.39 -45.04 81.38 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 125.206 1.402 . . . . 0.0 112.684 175.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.7 p -78.51 -27.28 14.14 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 CA-C-N 119.709 1.14 . . . . 0.0 113.488 -177.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 53.7 mmtt -90.97 -15.74 29.18 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 125.287 1.435 . . . . 0.0 113.494 173.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 16.0 mp0 54.69 63.94 1.98 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 127.412 2.285 . . . . 0.0 113.417 -175.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.7 mt -91.86 -8.13 47.38 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.59 0.756 . . . . 0.0 113.007 176.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 54.2 p90 -76.61 153.39 35.32 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.845 0.858 . . . . 0.0 111.072 170.028 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -82.82 130.81 35.18 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 121.719 -0.613 . . . . 0.0 110.828 171.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -64.11 -25.36 68.06 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 120.969 -1.082 . . . . 0.0 113.353 -177.73 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -91.69 -22.72 20.09 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 123.923 0.889 . . . . 0.0 111.671 -172.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -149.84 75.42 1.25 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 129.327 3.051 . . . . 0.0 109.662 -174.067 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 29.9 mp0 -60.7 -18.64 55.42 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -173.405 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 1.6 p-80 -63.7 -29.74 70.93 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 113.469 0.915 . . . . 0.0 113.469 169.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 16.9 tpp -81.35 130.01 34.86 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.515 1.126 . . . . 0.0 110.532 171.584 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.5 t -124.81 117.38 50.1 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 C-N-CA 126.099 1.76 . . . . 0.0 108.664 177.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -96.77 73.53 2.65 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.165 1.386 . . . . 0.0 110.713 -177.163 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 72.5 m -76.76 -0.81 25.16 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 121.208 -0.932 . . . . 0.0 112.944 171.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.58 -25.63 58.62 Favored Glycine 0 CA--C 1.541 1.685 0 O-C-N 120.557 -1.34 . . . . 0.0 113.879 169.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -87.56 3.77 86.19 Favored Glycine 0 CA--C 1.542 1.731 0 C-N-CA 125.32 1.438 . . . . 0.0 115.224 171.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -107.57 167.51 9.9 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 126.231 1.812 . . . . 0.0 112.438 -176.372 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.9 tp -46.61 -43.0 17.0 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.184 1.794 . . . . 0.0 111.917 169.152 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 13.9 tp -59.38 -41.35 89.15 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.412 1.485 . . . . 0.0 111.74 175.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -65.16 -42.35 96.49 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 124.935 1.255 . . . . 0.0 113.834 171.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -63.33 -47.31 82.74 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 120.211 2.006 . . . . 0.0 110.679 177.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.4 pp -70.36 -32.49 70.2 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -176.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.15 -9.04 31.58 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 119.783 1.174 . . . . 0.0 112.854 175.228 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 80.43 -26.5 3.03 Favored Glycine 0 CA--C 1.541 1.659 0 C-N-CA 125.909 1.718 . . . . 0.0 113.437 -171.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -161.27 134.84 6.61 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 128.741 2.817 . . . . 0.0 109.425 176.25 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -142.6 28.56 1.61 Allowed 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 119.132 0.878 . . . . 0.0 111.32 174.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.2 m -91.78 142.69 27.31 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 121.591 -0.693 . . . . 0.0 111.95 -178.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 50.0 p90 -160.97 169.44 22.56 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.315 1.046 . . . . 0.0 112.41 -169.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 5.3 t -125.01 136.49 53.76 Favored 'General case' 0 N--CA 1.462 0.148 0 C-N-CA 123.584 0.754 . . . . 0.0 110.755 169.305 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 33.9 m -71.35 -11.69 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 N-CA-C 114.325 1.231 . . . . 0.0 114.325 -174.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -73.88 -11.21 60.29 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.338 1.055 . . . . 0.0 113.549 169.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 47.0 t0 -121.39 77.71 35.36 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 126.9 2.08 . . . . 0.0 109.303 179.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -71.39 -28.26 18.29 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 123.478 2.786 . . . . 0.0 115.017 -169.347 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 49.8 m -57.35 -52.26 75.56 Favored Pre-proline 0 N--CA 1.477 0.898 0 CA-C-N 119.987 1.267 . . . . 0.0 114.25 -177.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -66.47 -30.63 43.54 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 122.193 1.929 . . . . 0.0 113.239 176.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 40.8 tp -65.55 -48.29 72.93 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.281 1.032 . . . . 0.0 110.312 175.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -60.45 -41.48 94.17 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 118.484 -0.769 . . . . 0.0 112.405 172.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -58.28 -47.53 83.34 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 120.128 1.331 . . . . 0.0 112.645 -179.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 46.0 mtm -66.32 -49.6 66.46 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.461 0.705 . . . . 0.0 112.314 175.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.7 mp -65.58 -37.16 85.87 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-O 117.957 -1.021 . . . . 0.0 111.571 -177.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 91.4 mtt180 -55.43 -22.7 21.45 Favored 'General case' 0 N--CA 1.484 1.226 0 CA-C-N 120.732 1.606 . . . . 0.0 113.828 169.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -92.16 -16.24 26.54 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.792 1.637 . . . . 0.0 113.709 175.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -128.72 -10.83 4.96 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 116.185 1.921 . . . . 0.0 116.185 -176.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.1 tt . . . . . 0 CA--C 1.542 0.666 0 C-N-CA 126.84 2.056 . . . . 0.0 111.315 -167.508 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 22.2 m . . . . . 0 N--CA 1.477 0.914 0 CA-C-O 120.725 0.298 . . . . 0.0 110.907 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 43.8 mtt180 -92.24 140.7 24.46 Favored Pre-proline 0 N--CA 1.48 1.027 0 C-N-CA 124.098 0.959 . . . . 0.0 111.502 -176.628 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -76.34 176.72 9.7 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 123.667 2.912 . . . . 0.0 111.327 169.578 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt -68.19 153.39 43.84 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.547 0.739 . . . . 0.0 110.58 179.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 93.5 mt -60.65 -43.9 93.68 Favored Pre-proline 0 N--CA 1.478 0.946 0 N-CA-C 114.543 1.312 . . . . 0.0 114.543 -169.376 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -65.85 -26.2 52.3 Favored 'Trans proline' 0 C--N 1.353 0.794 0 CA-C-N 121.616 1.613 . . . . 0.0 113.287 172.184 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.39 -42.33 75.27 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.437 1.095 . . . . 0.0 110.948 174.776 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.7 tt -61.12 -36.7 80.45 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 120.969 -1.082 . . . . 0.0 111.292 170.042 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -63.77 -37.95 89.27 Favored 'General case' 0 N--CA 1.482 1.154 0 O-C-N 121.082 -1.011 . . . . 0.0 113.394 169.839 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.8 mt -60.26 -41.63 87.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 CA-C-N 120.238 1.381 . . . . 0.0 111.434 171.05 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.8 mp -66.61 -36.71 83.26 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 119.428 1.013 . . . . 0.0 112.133 174.175 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 28.5 m170 -63.36 -43.17 98.43 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 121.046 -1.034 . . . . 0.0 111.674 172.007 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.66 -28.31 69.83 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.266 1.027 . . . . 0.0 113.042 173.539 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.44 -15.07 63.21 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 124.155 0.982 . . . . 0.0 113.302 172.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 102.23 8.17 44.82 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 125.997 1.76 . . . . 0.0 114.884 -176.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -95.95 173.38 7.46 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 118.803 1.301 . . . . 0.0 113.901 -176.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.5 tm0? -136.77 143.28 43.15 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.921 1.688 . . . . 0.0 109.248 169.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . 0.412 ' HA3' ' CZ ' ' A' ' 47' ' ' PHE . . . 169.68 -179.73 41.94 Favored Glycine 0 N--CA 1.467 0.706 0 N-CA-C 115.241 0.856 . . . . 0.0 115.241 179.738 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -139.47 -57.23 0.58 Allowed 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.129 1.772 . . . . 0.0 110.824 -178.068 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 16.0 mtm -103.73 142.01 35.1 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 127.988 2.515 . . . . 0.0 111.257 173.165 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.412 ' CZ ' ' HA3' ' A' ' 44' ' ' GLY . 76.5 m-85 -154.79 144.99 21.9 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.292 1.037 . . . . 0.0 112.662 -176.138 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 43.7 p -76.12 172.04 13.48 Favored 'General case' 0 N--CA 1.484 1.263 0 O-C-N 121.121 -0.987 . . . . 0.0 111.094 168.334 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -56.76 -40.95 73.81 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.258 0 O-C-N 120.718 -1.239 . . . . 0.0 110.683 168.754 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -68.24 -40.76 81.91 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.429 1.092 . . . . 0.0 112.61 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 59.7 mt-10 -66.65 -40.99 88.93 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.591 0.756 . . . . 0.0 111.551 175.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 52.9 t -61.37 -48.58 88.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 O-C-N 121.785 -0.572 . . . . 0.0 110.841 171.525 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.43 -38.12 89.93 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 125.91 1.684 . . . . 0.0 113.955 -176.402 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 85.3 t60 -53.24 -51.6 61.65 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.297 0.639 . . . . 0.0 111.623 171.077 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -74.56 -32.48 62.43 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 176.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -71.85 -39.25 69.84 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.674 1.124 . . . . 0.0 112.564 178.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -60.4 -41.11 98.4 Favored Glycine 0 CA--C 1.536 1.393 0 CA-C-N 119.358 0.981 . . . . 0.0 111.732 171.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.6 tp60 -60.24 -51.37 69.86 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.479 1.512 . . . . 0.0 111.913 170.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 55.6 t80 -58.93 -49.99 75.73 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.0 -1.062 . . . . 0.0 110.397 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 56.7 mt -62.29 -36.51 74.94 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 124.896 1.278 . . . . 0.0 111.373 179.298 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 5.8 tpt -64.58 -40.08 94.89 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 119.6 1.091 . . . . 0.0 112.26 172.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 96.6 t -78.31 -34.08 18.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 124.293 1.037 . . . . 0.0 112.971 -179.052 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 47.4 mmtt -89.11 -15.68 33.31 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.89 1.276 . . . . 0.0 113.06 178.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 14.8 mp0 49.06 69.11 0.61 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.409 2.284 . . . . 0.0 112.601 -171.204 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 9.8 tp -90.74 -1.49 57.85 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.119 0.968 . . . . 0.0 112.776 -176.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -102.09 158.64 16.02 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.861 2.064 . . . . 0.0 111.184 175.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -88.47 127.69 35.52 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 169.117 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.26 -33.21 52.14 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.882 1.068 . . . . 0.0 113.882 179.553 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -90.38 -16.28 29.42 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.577 1.151 . . . . 0.0 112.466 -173.388 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -143.1 64.56 1.35 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 128.059 2.544 . . . . 0.0 109.432 -177.071 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -60.06 -21.82 61.92 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 121.241 -0.912 . . . . 0.0 113.053 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 5.6 p-80 -65.87 -6.55 12.55 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.31 1.444 . . . . 0.0 114.18 169.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 7.2 tpp -117.55 132.12 56.58 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 127.376 2.27 . . . . 0.0 110.379 174.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 11.7 t -115.4 123.28 70.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 126.017 1.727 . . . . 0.0 108.298 175.28 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 81.0 t80 -109.14 103.68 12.72 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.21 1.004 . . . . 0.0 109.913 -178.068 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 73.0 m -95.67 15.11 20.89 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -175.047 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.54 118.8 14.8 Favored Glycine 0 CA--C 1.535 1.334 0 O-C-N 121.468 -0.77 . . . . 0.0 112.093 179.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 76.96 5.62 84.86 Favored Glycine 0 CA--C 1.541 1.717 0 C-N-CA 124.485 1.04 . . . . 0.0 115.512 -175.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -93.79 158.66 15.55 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.189 1.494 . . . . 0.0 112.044 174.51 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 64.6 mt -48.96 -35.38 15.01 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.811 1.244 . . . . 0.0 113.286 177.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -58.88 -45.37 90.38 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.595 0.758 . . . . 0.0 111.743 175.037 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -74.7 -33.93 54.59 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 125.407 1.48 . . . . 0.0 113.902 176.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -59.32 -46.55 88.3 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-N 120.748 2.274 . . . . 0.0 110.096 171.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 32.0 tp -68.88 -51.63 38.16 Favored 'General case' 0 CA--C 1.552 1.054 0 CA-C-N 114.303 -1.317 . . . . 0.0 113.178 -176.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -89.55 -8.34 52.95 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 124.312 1.045 . . . . 0.0 112.608 -177.224 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 83.98 -27.04 4.56 Favored Glycine 0 CA--C 1.541 1.657 0 O-C-N 119.866 -1.771 . . . . 0.0 112.714 -169.566 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.12 140.31 4.39 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 128.55 2.74 . . . . 0.0 110.655 178.288 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -142.76 35.98 1.43 Allowed 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.795 0.838 . . . . 0.0 110.931 169.411 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 5.1 m -86.86 125.01 33.7 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 120.712 -1.242 . . . . 0.0 109.663 169.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -163.6 169.18 18.99 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.176 1.391 . . . . 0.0 111.859 -169.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 13.0 m -115.65 136.14 53.36 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.045 -0.98 . . . . 0.0 111.536 176.173 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -77.76 -14.35 14.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 124.483 1.113 . . . . 0.0 113.519 -169.205 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.2 pttt -75.26 -8.36 56.41 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.478 1.511 . . . . 0.0 114.651 169.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -117.99 83.88 20.05 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 126.394 1.878 . . . . 0.0 110.522 -175.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -67.08 -31.44 36.75 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 123.725 2.95 . . . . 0.0 114.855 -171.677 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 54.5 m -58.32 -51.97 77.96 Favored Pre-proline 0 N--CA 1.476 0.85 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -176.066 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -67.28 -33.98 28.82 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 121.88 1.72 . . . . 0.0 112.58 174.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 8.2 tp -60.38 -46.48 89.82 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.867 1.267 . . . . 0.0 110.878 176.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -56.97 -38.27 72.75 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.294 0.952 . . . . 0.0 112.52 177.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -64.76 -51.46 62.17 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.584 1.084 . . . . 0.0 112.379 177.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -68.52 -29.52 68.13 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 114.06 1.133 . . . . 0.0 114.06 177.538 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 39.7 tp -75.58 -53.54 8.45 Favored 'General case' 0 C--O 1.224 -0.255 0 C-N-CA 126.506 1.922 . . . . 0.0 110.972 178.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 49.9 mtp180 -59.48 -27.39 66.08 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-N 119.42 1.009 . . . . 0.0 113.474 -176.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -75.97 -26.4 56.76 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.297 1.439 . . . . 0.0 113.691 173.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 34.5 m-20 -104.75 -21.54 13.35 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 179.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 21.0 tp . . . . . 0 CA--C 1.535 0.373 0 C-N-CA 127.916 2.487 . . . . 0.0 107.337 171.428 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.1 m . . . . . 0 N--CA 1.485 1.288 0 N-CA-C 113.332 0.864 . . . . 0.0 113.332 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 43.4 mtm180 -69.54 146.89 96.5 Favored Pre-proline 0 N--CA 1.486 1.371 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -169.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo -88.9 -177.14 1.56 Allowed 'Trans proline' 0 C--N 1.354 0.823 1 C-N-CA 125.392 4.061 . . . . 0.0 113.447 -176.304 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.0 ttmt -68.03 147.85 51.81 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.745 0.818 . . . . 0.0 109.128 169.182 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 92.4 mt -60.2 -42.07 87.67 Favored Pre-proline 0 N--CA 1.478 0.929 0 N-CA-C 115.354 1.612 . . . . 0.0 115.354 -168.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -59.58 -31.4 94.41 Favored 'Trans proline' 0 CA--C 1.537 0.631 0 CA-C-N 121.76 1.664 . . . . 0.0 114.032 176.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.1 tt -64.4 -44.77 90.22 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.071 0.851 . . . . 0.0 110.536 175.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 49.7 tp -61.11 -39.04 88.5 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.229 0.612 . . . . 0.0 111.797 175.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -67.21 -36.62 82.1 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 175.256 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 87.5 mt -63.89 -42.55 96.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 123.828 0.851 . . . . 0.0 111.346 171.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 97.7 mt -63.65 -37.2 86.45 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.154 -0.966 . . . . 0.0 112.661 173.143 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 65.2 m170 -61.76 -44.66 96.46 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 118.813 0.733 . . . . 0.0 111.581 169.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.76 -28.72 69.77 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.184 0.994 . . . . 0.0 112.976 177.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.99 -3.81 31.49 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.456 1.102 . . . . 0.0 113.552 172.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.81 12.32 60.74 Favored Glycine 0 CA--C 1.536 1.375 0 C-N-CA 125.177 1.37 . . . . 0.0 115.355 177.17 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -106.93 156.39 18.76 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.011 1.325 . . . . 0.0 112.736 -179.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -80.62 -178.48 6.76 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.684 -0.635 . . . . 0.0 111.07 169.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 176.79 155.01 12.56 Favored Glycine 0 C--N 1.34 0.781 0 N-CA-C 118.497 2.159 . . . . 0.0 118.497 176.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -147.01 -67.71 0.26 Allowed 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 127.227 2.211 . . . . 0.0 108.078 169.18 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 1.5 pmm? -130.09 154.63 47.27 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 126.214 1.806 . . . . 0.0 115.548 176.388 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -154.57 160.81 41.72 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 115.183 1.549 . . . . 0.0 115.183 -168.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 44.6 p -96.42 173.26 7.46 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 127.028 2.131 . . . . 0.0 109.893 167.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.2 t -56.54 -41.94 74.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 CA-C-N 120.785 1.629 . . . . 0.0 110.001 169.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 56.8 tptt -60.27 -43.17 96.43 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.729 1.15 . . . . 0.0 112.386 -179.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -74.12 -36.89 64.23 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 83.3 t -67.85 -50.57 58.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 CA-C-N 118.959 0.799 . . . . 0.0 111.013 172.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.6 ppp? -69.54 -26.52 64.54 Favored 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 114.55 1.315 . . . . 0.0 114.55 -168.572 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -57.77 -54.24 49.08 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.289 0.636 . . . . 0.0 110.826 171.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -74.54 -31.08 62.01 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 176.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -69.43 -39.1 78.06 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 120.61 1.55 . . . . 0.0 112.627 175.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.6 -47.36 89.81 Favored Glycine 0 CA--C 1.53 1.011 0 CA-C-N 118.986 0.812 . . . . 0.0 111.466 172.051 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.0 tp60 -57.62 -43.22 84.61 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.313 1.045 . . . . 0.0 112.356 172.503 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -62.79 -53.8 48.8 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.28 1.432 . . . . 0.0 110.621 177.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 34.7 mt -57.04 -37.36 54.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 124.288 1.035 . . . . 0.0 110.751 177.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 40.3 mmm -70.23 -41.47 73.55 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 114.141 1.163 . . . . 0.0 114.141 176.191 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.8 p -78.48 -26.31 13.92 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 CA-C-N 119.974 1.261 . . . . 0.0 112.99 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 55.5 mmtt -91.77 -14.44 29.87 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.817 1.647 . . . . 0.0 113.253 173.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.8 mp0 52.19 62.3 2.77 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 126.766 2.026 . . . . 0.0 113.673 -176.182 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 45.8 mt -88.37 -5.24 58.42 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 121.576 -0.703 . . . . 0.0 112.749 174.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 46.3 p90 -84.62 157.19 21.25 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.986 1.314 . . . . 0.0 111.703 172.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -87.41 126.83 35.11 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 169.454 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.46 -30.74 61.11 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 179.084 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -94.73 -21.08 18.98 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.712 1.205 . . . . 0.0 112.809 -170.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -140.07 68.44 1.36 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 127.765 2.426 . . . . 0.0 109.056 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -63.35 -16.96 61.99 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 114.05 1.13 . . . . 0.0 114.05 -169.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 32.8 p80 -61.53 -29.89 70.29 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 118.706 -0.664 . . . . 0.0 112.689 169.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 17.9 mtp -87.99 145.5 25.97 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 113.62 0.971 . . . . 0.0 113.62 176.186 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 t -131.0 131.21 64.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 C-N-CA 126.073 1.749 . . . . 0.0 108.743 173.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -112.66 103.57 11.61 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.553 1.541 . . . . 0.0 108.758 174.571 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 15.0 m -103.05 9.69 38.42 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.73 0.812 . . . . 0.0 112.402 176.008 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.75 -27.32 66.35 Favored Glycine 0 CA--C 1.537 1.444 0 C-N-CA 124.999 1.285 . . . . 0.0 114.795 -174.336 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -88.24 2.09 84.94 Favored Glycine 0 CA--C 1.54 1.631 0 C-N-CA 124.988 1.28 . . . . 0.0 115.202 173.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -110.67 177.78 4.57 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.471 1.508 . . . . 0.0 112.727 -175.061 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 80.4 mt -51.73 -35.84 44.79 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.205 1.402 . . . . 0.0 113.201 171.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 94.5 mt -61.2 -47.91 83.97 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 121.624 -0.673 . . . . 0.0 110.933 174.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -67.8 -34.79 83.76 Favored Glycine 0 CA--C 1.532 1.142 0 CA-C-O 119.032 -0.871 . . . . 0.0 113.464 176.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.42 -28.77 63.18 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 119.43 1.615 . . . . 0.0 112.449 176.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 40.8 tp -74.42 -53.61 9.23 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.875 1.27 . . . . 0.0 112.416 173.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -96.82 -17.24 20.34 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.787 1.403 . . . . 0.0 114.787 -169.442 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 80.85 -17.96 10.21 Favored Glycine 0 CA--C 1.539 1.584 0 C-N-CA 125.66 1.6 . . . . 0.0 116.061 -177.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.04 31.13 0.62 Allowed 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 116.362 1.986 . . . . 0.0 116.362 -174.23 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 8.0 mm-40 -69.35 73.17 0.33 Allowed 'General case' 0 N--CA 1.477 0.886 0 O-C-N 121.336 -0.852 . . . . 0.0 112.853 -179.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 12.1 m -134.38 136.43 43.36 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.083 1.353 . . . . 0.0 109.178 169.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 54.5 p90 -160.08 174.06 14.88 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -168.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.8 t -124.59 141.42 52.11 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 124.852 1.261 . . . . 0.0 110.548 169.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 25.9 m -72.0 -12.28 15.73 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 175.21 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 41.4 pttt -77.35 -10.71 59.61 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 113.683 0.994 . . . . 0.0 113.683 172.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -123.48 77.42 54.54 Favored Pre-proline 0 CA--C 1.548 0.866 0 C-N-CA 126.285 1.834 . . . . 0.0 109.642 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -68.83 -28.05 30.44 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 123.389 2.726 . . . . 0.0 114.873 -169.355 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 62.5 m -59.4 -55.14 49.05 Favored Pre-proline 0 N--CA 1.476 0.863 0 CA-C-N 120.172 1.351 . . . . 0.0 114.436 -177.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -65.88 -29.74 49.65 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 122.11 1.873 . . . . 0.0 112.93 176.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 26.5 tp -66.37 -46.48 76.55 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.89 0.876 . . . . 0.0 110.746 174.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -61.83 -39.25 91.14 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 118.557 -0.735 . . . . 0.0 112.638 172.253 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -59.36 -48.9 79.88 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 119.778 1.172 . . . . 0.0 112.599 177.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 41.3 mtm -62.31 -47.91 82.2 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.653 0.781 . . . . 0.0 112.634 173.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 61.7 mt -56.65 -45.26 81.73 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 124.312 1.045 . . . . 0.0 110.978 177.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 24.0 ttt180 -60.42 -21.64 62.47 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 120.052 1.296 . . . . 0.0 114.234 175.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -86.85 -17.5 33.21 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.5 1.52 . . . . 0.0 113.208 172.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 53.9 t30 -104.92 -25.19 12.69 Favored 'General case' 0 CA--C 1.555 1.138 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 176.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 55.1 tp . . . . . 0 CA--C 1.535 0.373 0 C-N-CA 128.739 2.816 . . . . 0.0 108.548 179.863 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 23.4 m . . . . . 0 N--CA 1.478 0.943 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.7 ttp-105 -101.39 129.85 26.04 Favored Pre-proline 0 N--CA 1.481 1.099 0 O-C-N 120.876 -1.14 . . . . 0.0 111.408 178.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -75.24 -177.03 3.22 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.736 2.958 . . . . 0.0 112.121 173.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.5 ttmt -64.06 148.09 50.6 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 121.394 -0.816 . . . . 0.0 110.668 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.9 mt -55.84 -45.85 99.83 Favored Pre-proline 0 N--CA 1.476 0.836 0 N-CA-C 115.225 1.565 . . . . 0.0 115.225 -168.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -64.8 -24.17 61.8 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 CA-C-N 122.219 1.828 . . . . 0.0 113.773 175.096 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 tp -66.68 -40.26 88.49 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.774 1.17 . . . . 0.0 110.919 172.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.9 tt -63.37 -37.91 89.09 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.824 0.85 . . . . 0.0 111.41 171.3 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.1 mmpt? -60.99 -43.21 99.2 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 121.516 -0.74 . . . . 0.0 112.565 171.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 83.3 mt -62.75 -42.38 96.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.994 0.918 . . . . 0.0 111.5 174.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 55.8 mt -63.57 -38.61 91.79 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.473 -0.767 . . . . 0.0 111.671 176.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 17.6 m170 -67.67 -41.05 84.32 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.584 -0.697 . . . . 0.0 111.789 172.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.37 -26.83 68.93 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.182 0.993 . . . . 0.0 113.292 174.043 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.25 -6.78 42.31 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.154 0.982 . . . . 0.0 113.462 171.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 94.75 7.19 60.24 Favored Glycine 0 CA--C 1.536 1.397 0 C-N-CA 125.638 1.59 . . . . 0.0 115.063 -178.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -89.09 170.64 10.46 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 118.931 1.365 . . . . 0.0 112.874 178.189 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 34.4 tp60 -128.14 139.03 52.72 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.607 1.563 . . . . 0.0 109.013 169.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 175.94 150.8 8.28 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 115.275 0.87 . . . . 0.0 115.275 -179.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -125.06 13.39 8.4 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 127.023 2.129 . . . . 0.0 111.641 172.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.2 mtm -174.9 134.44 0.35 Allowed 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 128.916 2.886 . . . . 0.0 109.343 -172.146 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -154.08 143.88 21.78 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.192 0.997 . . . . 0.0 113.145 -174.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 51.4 p -85.75 170.06 12.82 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 121.058 -1.026 . . . . 0.0 111.203 168.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 2.7 t -55.81 -43.92 75.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 O-C-N 120.337 -1.477 . . . . 0.0 110.391 169.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -57.29 -34.69 68.94 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 120.813 -1.179 . . . . 0.0 113.002 177.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -80.43 -45.79 17.04 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 113.183 0.808 . . . . 0.0 113.183 173.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 79.5 t -61.61 -49.1 85.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 123.482 0.713 . . . . 0.0 110.895 -177.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.71 -38.58 83.81 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 123.375 0.67 . . . . 0.0 111.944 -172.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -56.46 -52.45 64.65 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.423 176.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 45.9 m-85 -74.41 -29.93 61.71 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 176.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.4 mp -68.28 -37.91 81.18 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 120.793 1.633 . . . . 0.0 112.215 171.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -61.95 -43.41 99.22 Favored Glycine 0 CA--C 1.531 1.069 0 CA-C-N 119.13 0.877 . . . . 0.0 111.828 171.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.2 tp60 -60.89 -43.09 98.96 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.394 1.077 . . . . 0.0 112.446 171.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -61.35 -51.78 67.37 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.205 1.002 . . . . 0.0 110.58 175.44 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 69.1 mt -59.8 -38.56 76.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 124.54 1.136 . . . . 0.0 110.825 179.095 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.2 tpt -63.63 -47.63 80.56 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.985 1.314 . . . . 0.0 112.509 174.127 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.2 p -78.63 -28.46 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 -175.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 57.5 mmtt -91.97 -15.78 27.48 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.459 1.503 . . . . 0.0 113.522 174.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.4 mp0 55.06 63.6 2.07 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.947 2.099 . . . . 0.0 112.992 -174.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 11.2 tp -88.29 -9.37 53.06 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.003 0.921 . . . . 0.0 112.3 176.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 26.4 p90 -88.58 162.08 16.57 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.134 1.774 . . . . 0.0 110.874 169.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -99.9 129.67 46.01 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 122.029 -0.42 . . . . 0.0 110.72 169.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.2 -20.57 59.29 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 113.934 1.087 . . . . 0.0 113.934 173.847 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -82.94 -31.44 27.7 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.639 1.176 . . . . 0.0 111.347 -178.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -152.33 69.99 0.9 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.262 1.825 . . . . 0.0 111.957 -169.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 27.9 mp0 -56.36 -20.8 20.91 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.233 1.413 . . . . 0.0 113.795 -178.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 30.5 p80 -65.32 -12.82 55.67 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 174.067 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 22.5 tpp -111.61 135.97 51.46 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 126.621 1.968 . . . . 0.0 111.105 172.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 18.9 t -119.7 107.89 22.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 125.713 1.605 . . . . 0.0 108.309 171.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -92.15 110.98 22.37 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.223 0.609 . . . . 0.0 110.672 -177.143 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 84.3 m -103.58 14.84 30.35 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 -170.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.47 120.74 23.6 Favored Glycine 0 CA--C 1.535 1.303 0 O-C-N 121.411 -0.805 . . . . 0.0 111.711 176.235 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 80.0 0.59 85.93 Favored Glycine 0 CA--C 1.54 1.625 0 C-N-CA 124.533 1.063 . . . . 0.0 115.575 -174.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -80.39 158.07 26.11 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.42 1.61 . . . . 0.0 111.496 171.191 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 10.9 mp -46.69 -41.16 14.51 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.312 1.445 . . . . 0.0 112.336 169.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 98.6 mt -57.52 -43.39 84.26 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.028 0.931 . . . . 0.0 111.703 174.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -72.64 -36.74 58.26 Favored Glycine 0 CA--C 1.53 0.981 0 CA-C-O 118.499 -1.167 . . . . 0.0 113.42 178.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -62.56 -42.55 99.61 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 120.318 2.059 . . . . 0.0 110.425 173.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 30.9 tp -65.34 -50.44 65.62 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.314 1.046 . . . . 0.0 113.191 -179.139 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -95.06 -7.64 38.98 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 124.782 1.233 . . . . 0.0 112.611 -175.363 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 82.47 -28.05 3.54 Favored Glycine 0 CA--C 1.541 1.662 0 C-N-CA 125.795 1.664 . . . . 0.0 113.167 -169.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.48 136.51 6.4 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 129.01 2.924 . . . . 0.0 109.265 176.544 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -139.32 22.96 2.55 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 119.267 0.939 . . . . 0.0 112.218 177.512 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 14.7 m -84.78 129.59 34.8 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 179.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 5.1 p90 -159.29 171.26 20.15 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.854 -1.066 . . . . 0.0 112.251 -168.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 79.9 p -113.39 136.26 52.96 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 114.659 -1.155 . . . . 0.0 113.434 177.122 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 3.7 m -77.65 -9.86 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 N-CA-C 114.066 1.136 . . . . 0.0 114.066 -177.243 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -80.91 -8.73 59.81 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.859 1.664 . . . . 0.0 115.149 174.227 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 39.0 t0 -131.29 90.11 39.24 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 125.519 1.527 . . . . 0.0 111.197 -172.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -67.46 -27.39 39.76 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 123.595 2.863 . . . . 0.0 115.08 -174.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 66.0 m -61.11 -53.16 66.21 Favored Pre-proline 0 N--CA 1.476 0.872 0 N-CA-C 114.326 1.232 . . . . 0.0 114.326 -177.562 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -66.6 -31.64 40.5 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 122.364 2.043 . . . . 0.0 112.761 175.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 6.5 tp -60.98 -49.02 79.12 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.779 1.232 . . . . 0.0 111.093 173.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -59.03 -29.26 67.15 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 -176.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -68.78 -51.52 40.14 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.604 1.093 . . . . 0.0 111.822 177.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 3.4 ptt? -68.86 -29.52 67.84 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.021 0.928 . . . . 0.0 112.633 178.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 17.7 tp -76.15 -47.13 25.44 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 126.821 2.049 . . . . 0.0 111.44 179.409 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 74.5 mtt180 -57.34 -27.47 62.27 Favored 'General case' 0 N--CA 1.485 1.282 0 CA-C-N 120.379 1.445 . . . . 0.0 113.16 176.08 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 90.4 mttt -76.49 -24.02 53.79 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.511 1.525 . . . . 0.0 113.509 174.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 60.2 m-20 -112.64 -22.23 10.86 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -177.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.6 tt . . . . . 0 CA--C 1.543 0.678 0 C-N-CA 127.701 2.4 . . . . 0.0 108.265 -173.856 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 24.1 m . . . . . 0 N--CA 1.479 0.984 0 CA-C-O 120.238 0.066 . . . . 0.0 110.869 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 -79.7 144.55 60.72 Favored Pre-proline 0 N--CA 1.483 1.201 0 O-C-N 121.125 -0.984 . . . . 0.0 110.934 -172.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -73.12 176.71 8.75 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 123.542 2.828 . . . . 0.0 112.291 176.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -58.22 146.81 32.52 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.873 0.869 . . . . 0.0 110.054 173.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.1 mp -56.5 -46.41 99.82 Favored Pre-proline 0 N--CA 1.476 0.864 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -169.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -66.75 -25.27 46.4 Favored 'Trans proline' 0 C--N 1.351 0.687 0 CA-C-N 121.513 1.576 . . . . 0.0 113.706 176.007 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.1 tt -69.73 -40.84 75.97 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.235 0.925 . . . . 0.0 109.972 173.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 28.6 tp -59.6 -36.92 77.24 Favored 'General case' 0 CA--C 1.547 0.846 0 O-C-N 120.954 -1.091 . . . . 0.0 111.421 169.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 19.7 mmtp -67.1 -33.72 76.08 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 173.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 83.4 mt -62.29 -38.99 82.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 124.439 1.096 . . . . 0.0 111.728 170.687 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.7 mp -68.95 -37.22 78.73 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 120.076 1.307 . . . . 0.0 112.356 171.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 58.7 m170 -60.87 -43.55 98.26 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 119.22 0.918 . . . . 0.0 111.697 172.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.66 -23.44 67.26 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.939 1.296 . . . . 0.0 113.416 175.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.08 -6.7 44.33 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 123.711 0.804 . . . . 0.0 113.089 171.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.73 19.38 40.82 Favored Glycine 0 CA--C 1.536 1.351 0 C-N-CA 125.142 1.353 . . . . 0.0 114.712 178.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -126.24 145.27 50.47 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.868 1.267 . . . . 0.0 113.133 -175.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -74.5 153.6 39.05 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.915 0.886 . . . . 0.0 110.177 169.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -150.76 134.92 4.94 Favored Glycine 0 CA--C 1.529 0.922 0 N-CA-C 115.601 1.0 . . . . 0.0 115.601 179.479 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -148.88 78.57 1.4 Allowed 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 127.168 2.187 . . . . 0.0 108.847 173.592 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . 0.435 0.0 OUTLIER 64.87 141.01 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 129.536 3.134 . . . . 0.0 117.838 176.072 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -161.8 171.56 17.6 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 114.055 1.131 . . . . 0.0 114.055 -168.735 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 37.7 p -96.47 174.23 6.96 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 127.109 2.163 . . . . 0.0 112.523 169.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 15.9 t -50.19 -46.12 24.6 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 O-C-N 121.173 -0.954 . . . . 0.0 111.545 171.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -57.37 -38.51 74.33 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.752 0.821 . . . . 0.0 112.639 -176.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -80.51 -34.95 35.26 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.42 1.088 . . . . 0.0 112.948 176.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 73.2 t -72.79 -45.88 55.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 O-C-N 121.215 -0.928 . . . . 0.0 112.291 -179.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 22.3 mmt -64.59 -30.66 71.68 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-N 120.012 1.278 . . . . 0.0 112.643 -178.303 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 85.4 t60 -53.85 -53.75 48.18 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.431 173.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -74.61 -34.27 62.79 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 174.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -70.29 -43.72 69.82 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.775 1.17 . . . . 0.0 112.814 -179.411 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.98 -39.68 98.37 Favored Glycine 0 CA--C 1.531 1.084 0 CA-C-N 118.843 0.747 . . . . 0.0 111.873 173.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.2 tp60 -61.18 -48.09 83.16 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.667 1.187 . . . . 0.0 111.934 172.146 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -60.7 -50.07 74.95 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.811 0.844 . . . . 0.0 110.885 177.29 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 60.4 mt -61.76 -35.76 69.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 124.817 1.247 . . . . 0.0 111.26 179.006 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.2 tpt -65.53 -39.52 91.87 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.595 1.158 . . . . 0.0 112.514 171.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 84.3 t -78.32 -32.97 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 CA-C-N 119.336 0.971 . . . . 0.0 112.969 -179.065 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 47.8 mmtt -90.46 -15.53 30.68 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.021 1.329 . . . . 0.0 113.15 177.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.3 mp0 50.17 66.45 1.14 Allowed 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 127.295 2.238 . . . . 0.0 113.183 -173.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 51.5 mt -91.2 0.64 57.49 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.52 0.728 . . . . 0.0 112.901 177.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 54.4 p90 -89.3 157.49 18.18 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.945 1.298 . . . . 0.0 111.354 171.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -88.52 134.58 33.82 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 121.86 -0.525 . . . . 0.0 110.69 169.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.47 -21.34 65.39 Favored 'General case' 0 CA--C 1.544 0.727 0 O-C-N 120.893 -1.129 . . . . 0.0 113.689 172.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -82.69 -34.57 27.32 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.704 1.202 . . . . 0.0 111.101 -179.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -147.89 76.35 1.38 Allowed 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 128.035 2.534 . . . . 0.0 109.43 -169.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 26.3 mp0 -59.34 -23.56 62.61 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.299 -0.876 . . . . 0.0 113.003 -178.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 3.3 p-80 -66.12 -23.22 66.45 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 171.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 12.6 tpp -87.06 132.05 33.93 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.758 1.223 . . . . 0.0 110.092 170.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.7 t -124.41 112.09 30.99 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 C-N-CA 126.577 1.951 . . . . 0.0 108.968 -175.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 58.0 t80 -89.98 59.26 4.47 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.411 1.485 . . . . 0.0 111.468 -176.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 52.5 m -72.28 -4.51 30.06 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 120.832 -1.168 . . . . 0.0 113.021 171.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.3 -24.65 59.27 Favored Glycine 0 CA--C 1.541 1.682 0 CA-C-N 120.648 1.567 . . . . 0.0 113.819 169.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -91.1 6.54 81.5 Favored Glycine 0 CA--C 1.542 1.778 0 C-N-CA 125.528 1.537 . . . . 0.0 115.326 171.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -112.13 171.1 7.71 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.249 1.82 . . . . 0.0 112.494 -173.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.1 mp -47.16 -40.23 15.37 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.244 1.418 . . . . 0.0 111.969 169.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.1 tp -64.76 -32.22 73.81 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.879 0.872 . . . . 0.0 111.945 175.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -75.11 -35.09 50.38 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 126.515 2.007 . . . . 0.0 114.458 174.331 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -65.63 -42.62 91.29 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 119.791 1.796 . . . . 0.0 110.232 169.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 25.6 tp -60.59 -49.33 77.96 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.155 1.382 . . . . 0.0 112.588 179.29 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.34 -11.09 21.52 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 115.478 1.658 . . . . 0.0 115.478 -177.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.11 -18.81 8.95 Favored Glycine 0 CA--C 1.539 1.59 0 C-N-CA 125.843 1.687 . . . . 0.0 115.968 179.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.33 28.64 0.57 Allowed 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 115.018 1.488 . . . . 0.0 115.018 -175.617 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -70.66 46.34 0.09 Allowed 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 116.212 1.93 . . . . 0.0 116.212 -168.21 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 41.0 m -105.93 142.41 35.68 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 120.789 -1.194 . . . . 0.0 110.491 170.155 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . 0.406 ' CD1' ' HE1' ' A' ' 101' ' ' MET . 52.7 p90 -161.39 171.4 18.31 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 -168.126 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 3.5 m -121.92 136.26 54.92 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.247 1.019 . . . . 0.0 111.389 174.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 22.4 m -74.22 -21.65 17.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 C-N-CA 124.214 1.005 . . . . 0.0 113.707 -175.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -72.72 -8.58 56.06 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 125.335 1.454 . . . . 0.0 114.375 174.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 47.0 t0 -117.64 82.78 16.47 Favored Pre-proline 0 CA--C 1.547 0.851 0 C-N-CA 126.786 2.034 . . . . 0.0 109.097 -179.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -66.57 -31.9 40.25 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 123.478 2.785 . . . . 0.0 114.591 -169.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 55.7 m -56.7 -54.19 56.53 Favored Pre-proline 0 N--CA 1.476 0.856 0 CA-C-N 120.057 1.299 . . . . 0.0 113.949 -176.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -66.2 -28.52 47.98 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 122.071 1.847 . . . . 0.0 113.209 175.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 32.4 tp -69.61 -43.47 72.68 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.145 -0.972 . . . . 0.0 111.255 176.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -65.92 -34.3 77.8 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 121.496 -0.753 . . . . 0.0 112.329 171.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -63.08 -46.74 86.01 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.348 0.976 . . . . 0.0 112.578 175.006 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.406 ' HE1' ' CD1' ' A' ' 90' ' ' PHE . 47.7 mtm -60.2 -49.92 75.73 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.244 0.618 . . . . 0.0 111.656 170.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 49.6 mt -59.92 -45.52 92.31 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-O 118.023 -0.989 . . . . 0.0 111.648 -176.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -55.09 -25.81 33.8 Favored 'General case' 0 N--CA 1.48 1.038 0 CA-C-N 119.926 1.239 . . . . 0.0 114.139 175.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -94.22 -16.77 23.34 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 125.322 1.449 . . . . 0.0 114.782 174.318 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 24.9 m-80 -117.95 -41.86 2.87 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-N 119.418 1.008 . . . . 0.0 113.598 -171.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 39.5 tp . . . . . 0 CA--C 1.54 0.565 0 C-N-CA 126.614 1.966 . . . . 0.0 107.971 169.561 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.1 m . . . . . 0 N--CA 1.477 0.908 0 CA-C-O 120.627 0.251 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 42.8 ttp180 -110.42 134.98 20.68 Favored Pre-proline 0 N--CA 1.479 0.987 0 C-N-CA 124.195 0.998 . . . . 0.0 112.914 -169.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.01 159.2 54.08 Favored 'Trans proline' 0 CA--C 1.537 0.637 0 C-N-CA 122.367 2.044 . . . . 0.0 111.788 169.575 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -55.55 161.19 2.12 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 115.027 1.492 . . . . 0.0 115.027 177.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 22.2 mt -61.15 -41.72 82.26 Favored Pre-proline 0 CA--C 1.548 0.881 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 -168.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -70.08 -30.76 20.28 Favored 'Trans proline' 0 C--N 1.355 0.871 0 C-N-CA 122.152 1.901 . . . . 0.0 112.763 169.557 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 tt -71.95 -43.87 64.5 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.795 1.238 . . . . 0.0 110.841 -175.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 23.8 tp -53.65 -37.28 62.97 Favored 'General case' 0 CA--C 1.548 0.899 0 O-C-N 120.98 -1.075 . . . . 0.0 111.801 171.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -72.41 -19.18 61.64 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.198 0.999 . . . . 0.0 113.695 177.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 84.7 mt -69.49 -41.72 80.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 CA-C-N 118.988 0.813 . . . . 0.0 109.074 168.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.4 mp -66.73 -35.92 81.25 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 121.564 -0.71 . . . . 0.0 110.913 175.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 50.6 m170 -60.85 -49.51 77.17 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 118.362 0.528 . . . . 0.0 111.535 169.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.18 -23.85 67.62 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.525 1.13 . . . . 0.0 113.903 177.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.43 -14.83 63.28 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.402 1.081 . . . . 0.0 113.066 173.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.74 22.52 10.98 Favored Glycine 0 CA--C 1.537 1.415 0 C-N-CA 125.26 1.41 . . . . 0.0 114.557 179.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -132.42 154.9 49.38 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.83 1.252 . . . . 0.0 113.581 -174.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.9 tt0 -77.39 152.35 34.42 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.718 0.807 . . . . 0.0 110.128 169.534 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -144.73 126.17 2.58 Favored Glycine 0 N--CA 1.469 0.88 0 N-CA-C 114.88 0.712 . . . . 0.0 114.88 178.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -151.06 78.35 1.29 Allowed 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 126.748 2.019 . . . . 0.0 108.931 173.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 30.7 mtm 67.18 140.86 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 129.668 3.187 . . . . 0.0 117.112 174.189 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -170.41 166.03 8.58 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.983 1.313 . . . . 0.0 113.489 -169.506 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 66.9 p -74.04 167.69 21.01 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 125.188 1.395 . . . . 0.0 111.497 168.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -59.63 -39.07 78.55 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.387 0 O-C-N 120.5 -1.375 . . . . 0.0 111.904 174.029 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -62.28 -44.04 97.44 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.716 1.606 . . . . 0.0 112.876 176.146 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -67.84 -37.46 81.91 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 121.908 -0.495 . . . . 0.0 111.857 172.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 33.3 t -61.5 -43.91 97.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 123.617 0.767 . . . . 0.0 111.317 173.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 19.4 ptp -73.08 -23.93 60.6 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 115.579 1.696 . . . . 0.0 115.579 -178.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 84.5 t60 -51.72 -44.04 63.07 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 118.73 0.695 . . . . 0.0 110.321 168.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 -74.79 -44.0 51.79 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 170.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.6 mp -67.25 -34.42 77.39 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 120.32 1.418 . . . . 0.0 113.873 -177.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.45 -47.37 87.98 Favored Glycine 0 CA--C 1.531 1.091 0 CA-C-N 119.222 0.919 . . . . 0.0 111.572 171.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 11.2 tp60 -54.93 -46.14 74.89 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.596 1.158 . . . . 0.0 111.604 171.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -62.55 -51.37 67.65 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.656 0.782 . . . . 0.0 110.828 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 67.8 mt -61.67 -37.24 77.51 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 123.758 0.823 . . . . 0.0 111.034 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 35.4 mmt -67.38 -42.45 83.36 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 174.043 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 6.6 p -78.54 -28.75 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 CA-C-N 119.869 1.213 . . . . 0.0 113.386 -177.246 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 57.4 mmtt -92.2 -15.83 27.04 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.905 1.282 . . . . 0.0 113.446 174.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 14.1 mp0 53.12 67.19 1.04 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.213 1.805 . . . . 0.0 113.06 -174.243 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.7 tp -90.31 3.83 52.51 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.34 1.056 . . . . 0.0 112.376 179.641 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 40.0 p90 -109.16 160.59 15.96 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 128.183 2.593 . . . . 0.0 110.725 178.194 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -94.54 130.71 40.84 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 109.273 -0.639 . . . . 0.0 109.273 168.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -57.03 -33.81 67.58 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 119.11 0.868 . . . . 0.0 112.737 -175.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -87.07 -15.13 39.48 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.873 0.869 . . . . 0.0 112.343 -172.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -141.97 57.47 1.48 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 127.875 2.47 . . . . 0.0 110.512 -176.303 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -60.31 -17.46 42.94 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 121.381 -0.824 . . . . 0.0 112.728 178.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 6.1 p-80 -63.42 -5.38 3.57 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.272 1.429 . . . . 0.0 114.332 169.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 48.1 mtp -128.35 150.75 49.96 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.97 1.259 . . . . 0.0 112.844 169.047 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 t -127.29 140.55 48.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 126.314 1.846 . . . . 0.0 108.243 175.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 86.1 m-85 -120.68 68.23 0.86 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.1 0.96 . . . . 0.0 112.622 -168.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 1.9 m -84.81 13.5 5.78 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 -170.269 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.82 -28.63 63.47 Favored Glycine 0 CA--C 1.541 1.705 0 O-C-N 120.473 -1.392 . . . . 0.0 114.663 178.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -94.15 5.95 72.04 Favored Glycine 0 CA--C 1.541 1.697 0 C-N-CA 125.358 1.456 . . . . 0.0 115.059 172.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -97.81 175.59 6.11 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.914 1.686 . . . . 0.0 112.53 -175.055 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 10.5 mp -59.56 -36.32 75.97 Favored 'General case' 0 CA--C 1.547 0.828 0 O-C-N 121.022 -1.048 . . . . 0.0 111.451 169.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 80.5 mt -57.64 -41.54 81.61 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.173 -0.954 . . . . 0.0 111.384 169.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -69.63 -35.3 74.11 Favored Glycine 0 CA--C 1.533 1.169 0 CA-C-O 118.709 -1.05 . . . . 0.0 113.821 176.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -72.94 -29.45 63.11 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 120.333 2.067 . . . . 0.0 111.477 176.398 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 29.2 tp -70.79 -50.47 35.4 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.104 1.362 . . . . 0.0 112.449 174.011 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.58 -6.4 23.9 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 124.628 1.171 . . . . 0.0 113.969 -171.182 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.47 -28.88 2.31 Favored Glycine 0 CA--C 1.54 1.647 0 C-N-CA 125.571 1.558 . . . . 0.0 113.759 -171.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.89 135.05 11.18 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 128.134 2.574 . . . . 0.0 110.005 176.85 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -148.54 42.75 0.99 Allowed 'General case' 0 N--CA 1.476 0.857 0 CA-C-O 122.283 1.039 . . . . 0.0 110.373 179.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 14.8 m -93.54 136.34 33.91 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 121.5 -0.75 . . . . 0.0 110.268 170.122 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 53.8 p90 -158.85 167.52 29.22 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.293 1.037 . . . . 0.0 113.497 -169.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 9.7 t -103.7 136.51 43.27 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.57 1.148 . . . . 0.0 111.468 170.29 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 5.5 m -77.83 -11.7 13.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 N-CA-C 114.859 1.429 . . . . 0.0 114.859 178.235 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 18.8 pttm -84.06 -8.53 59.09 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 115.26 1.578 . . . . 0.0 115.26 -176.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 42.2 t0 -120.58 96.22 48.93 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 126.148 1.779 . . . . 0.0 111.132 -169.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -60.37 -30.89 91.93 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 124.095 3.197 . . . . 0.0 115.315 -178.428 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 69.3 m -60.44 -55.02 49.24 Favored Pre-proline 0 N--CA 1.477 0.905 0 CA-C-N 120.264 1.393 . . . . 0.0 113.913 -177.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -67.1 -27.76 41.66 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 122.064 1.842 . . . . 0.0 112.795 175.182 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 46.4 mt -61.45 -53.95 49.84 Favored 'General case' 0 C--N 1.344 0.341 0 CA-C-N 119.155 0.889 . . . . 0.0 110.535 173.184 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -58.94 -39.38 81.46 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.122 0.873 . . . . 0.0 113.012 176.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -58.67 -49.19 78.48 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 118.763 0.71 . . . . 0.0 112.572 177.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 45.2 mtm -68.14 -47.38 68.25 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.249 0.62 . . . . 0.0 112.317 175.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 69.4 mt -54.52 -47.98 72.48 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.229 1.012 . . . . 0.0 111.034 -178.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -59.56 -22.07 61.2 Favored 'General case' 0 N--CA 1.482 1.165 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 175.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -88.42 -22.05 23.94 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 125.977 1.711 . . . . 0.0 113.727 173.559 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -111.26 -33.72 6.36 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -170.59 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 42.7 tp . . . . . 0 CA--C 1.54 0.57 0 C-N-CA 126.957 2.103 . . . . 0.0 108.938 169.137 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 . . . . . 0 CA--C 1.547 0.847 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -99.16 30.67 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.988 0 C-N-CA 126.941 2.096 . . . . 0.0 111.711 -176.497 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 53.9 t30 50.43 38.71 18.91 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 126.049 1.74 . . . . 0.0 113.32 -174.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 14.4 pm0 -85.02 168.61 14.76 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.067 1.747 . . . . 0.0 113.099 -173.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 31.1 m -110.1 172.07 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 C-N-CA 126.223 1.809 . . . . 0.0 112.941 -169.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 42.7 mtm180 -86.83 143.14 34.99 Favored Pre-proline 0 N--CA 1.48 1.055 0 O-C-N 121.304 -0.873 . . . . 0.0 111.862 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -81.48 -179.28 4.82 Favored 'Trans proline' 0 CA--C 1.535 0.529 0 C-N-CA 124.371 3.381 . . . . 0.0 112.447 173.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.9 ttmt -70.38 149.68 47.05 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.034 0.534 . . . . 0.0 109.932 175.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 85.4 mt -62.44 -41.76 75.8 Favored Pre-proline 0 N--CA 1.478 0.933 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 -168.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -63.33 -29.81 72.76 Favored 'Trans proline' 0 C--N 1.349 0.582 0 CA-C-N 121.58 1.6 . . . . 0.0 114.001 171.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 7.9 tp -64.68 -42.01 95.66 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 119.591 1.087 . . . . 0.0 110.549 172.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.1 tt -64.34 -35.09 79.73 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.012 0.925 . . . . 0.0 111.792 174.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -66.3 -41.39 89.83 Favored 'General case' 0 N--CA 1.483 1.219 0 O-C-N 120.954 -1.091 . . . . 0.0 113.089 170.159 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 74.5 mt -62.46 -39.0 82.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 CA-C-N 119.413 1.006 . . . . 0.0 111.179 173.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 52.4 mt -65.3 -42.12 93.4 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.083 0.953 . . . . 0.0 111.919 173.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 34.4 m170 -61.56 -41.13 96.93 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.15 -0.969 . . . . 0.0 112.172 171.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.54 -27.52 69.02 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.89 0.876 . . . . 0.0 112.964 176.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.66 -3.55 31.98 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.303 1.041 . . . . 0.0 113.515 172.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 92.28 6.83 64.3 Favored Glycine 0 CA--C 1.537 1.449 0 C-N-CA 125.542 1.544 . . . . 0.0 114.821 -178.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -85.49 168.34 14.63 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 118.745 1.272 . . . . 0.0 113.327 179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 22.2 tm0? -135.36 140.89 45.39 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.712 1.605 . . . . 0.0 108.157 168.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 175.03 172.93 40.39 Favored Glycine 0 CA--C 1.526 0.73 0 N-CA-C 115.512 0.965 . . . . 0.0 115.512 -176.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -133.23 -58.25 0.9 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 126.227 1.811 . . . . 0.0 109.889 173.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 21.5 mtm -95.62 137.26 34.93 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.049 1.739 . . . . 0.0 111.568 175.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 84.6 m-85 -150.45 138.4 20.08 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.719 1.208 . . . . 0.0 112.532 -178.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 51.1 p -81.94 169.57 16.63 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.164 0.986 . . . . 0.0 110.477 168.172 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -56.39 -36.59 47.51 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 O-C-N 120.459 -1.401 . . . . 0.0 111.434 172.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 54.9 tptt -68.03 -44.79 75.68 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.726 1.211 . . . . 0.0 112.56 176.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 58.5 mt-10 -66.1 -36.81 84.16 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.206 0.602 . . . . 0.0 112.014 176.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 66.8 t -61.87 -50.37 80.43 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 C-N-CA 123.25 0.62 . . . . 0.0 110.409 170.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.35 -39.16 93.78 Favored 'General case' 0 C--N 1.334 -0.094 0 C-N-CA 126.261 1.824 . . . . 0.0 114.279 -172.338 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 83.1 t60 -51.59 -52.57 46.44 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 122.732 0.413 . . . . 0.0 111.309 174.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -74.79 -32.68 62.07 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 115.103 1.519 . . . . 0.0 115.103 174.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -70.25 -40.68 74.28 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 120.779 1.627 . . . . 0.0 112.89 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -60.62 -47.35 91.59 Favored Glycine 0 CA--C 1.53 0.978 0 N-CA-C 110.914 -0.875 . . . . 0.0 110.914 171.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 11.6 tp60 -57.17 -42.37 80.98 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.296 1.038 . . . . 0.0 112.503 173.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -63.96 -51.54 63.87 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.817 1.247 . . . . 0.0 110.784 178.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 37.1 mt -61.66 -37.74 78.69 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 C-N-CA 123.869 0.868 . . . . 0.0 110.793 178.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 34.9 mmt -66.73 -43.16 84.93 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 174.047 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 7.4 p -78.49 -28.6 14.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 CA-C-N 119.894 1.225 . . . . 0.0 113.386 -176.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 20.2 mmtp -91.13 -15.81 28.81 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.052 1.341 . . . . 0.0 113.458 173.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 14.6 mp0 54.18 63.34 2.21 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.078 1.751 . . . . 0.0 112.707 -174.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 13.6 tp -92.3 12.59 21.97 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.047 1.339 . . . . 0.0 111.961 -178.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 32.9 p90 -123.02 160.68 25.8 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 128.482 2.713 . . . . 0.0 110.625 -177.115 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.2 t0 -92.82 128.61 38.75 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 169.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.27 -30.95 52.4 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 179.709 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -94.11 -16.41 23.8 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.004 1.322 . . . . 0.0 112.559 -172.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -139.57 59.46 1.59 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 127.43 2.292 . . . . 0.0 109.83 -177.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -63.23 -17.75 62.79 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.526 0.73 . . . . 0.0 111.961 -178.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 6.4 p-80 -63.91 -1.39 1.41 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.353 1.461 . . . . 0.0 113.429 168.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 36.3 mtp -128.03 145.43 50.99 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 120.293 1.406 . . . . 0.0 111.618 168.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.7 t -127.36 140.26 49.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 125.484 1.514 . . . . 0.0 108.208 173.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 -112.74 52.61 0.77 Allowed 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.378 1.071 . . . . 0.0 113.818 -168.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 32.6 m -70.5 1.73 4.78 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -176.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.57 -25.45 55.36 Favored Glycine 0 CA--C 1.541 1.69 0 CA-C-N 120.558 1.527 . . . . 0.0 114.185 169.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -89.26 5.87 83.86 Favored Glycine 0 CA--C 1.542 1.727 0 C-N-CA 125.375 1.464 . . . . 0.0 115.327 171.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -109.46 172.36 6.9 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.335 1.854 . . . . 0.0 112.058 -174.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 88.5 mt -55.02 -35.62 64.62 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 120.986 -1.071 . . . . 0.0 112.352 169.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.1 tp -60.46 -42.58 96.49 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.738 0.815 . . . . 0.0 111.116 174.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -65.92 -44.36 91.95 Favored Glycine 0 CA--C 1.529 0.937 0 C-N-CA 125.378 1.466 . . . . 0.0 113.627 172.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.2 -26.91 65.96 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.376 1.588 . . . . 0.0 112.356 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 28.2 tp -71.83 -54.56 9.77 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.036 1.334 . . . . 0.0 111.996 169.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -88.64 -5.15 58.34 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-N 118.771 0.714 . . . . 0.0 112.71 -170.613 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 78.69 -27.89 2.17 Favored Glycine 0 CA--C 1.54 1.605 0 C-N-CA 126.131 1.824 . . . . 0.0 113.291 -170.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.81 134.85 9.0 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 128.28 2.632 . . . . 0.0 109.741 176.317 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -145.17 28.39 1.22 Allowed 'General case' 0 N--CA 1.476 0.863 0 O-C-N 121.3 -0.875 . . . . 0.0 110.876 174.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 14.9 m -87.92 135.61 33.33 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 121.59 -0.694 . . . . 0.0 109.387 170.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 17.5 p90 -158.26 168.75 26.18 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 123.84 0.856 . . . . 0.0 113.215 -169.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 14.9 t -110.26 136.19 49.84 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 122.373 1.082 . . . . 0.0 112.217 170.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -78.09 -13.66 13.93 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-N 114.08 -1.418 . . . . 0.0 114.115 -171.321 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 47.5 pttt -81.26 -7.31 59.55 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 125.867 1.667 . . . . 0.0 115.034 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -119.36 85.22 30.66 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 126.07 1.748 . . . . 0.0 110.828 -172.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.25 -27.32 56.15 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.953 3.102 . . . . 0.0 115.261 -172.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 68.2 m -63.59 -55.89 30.8 Favored Pre-proline 0 N--CA 1.478 0.928 0 CA-C-N 119.924 1.238 . . . . 0.0 114.036 -177.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -66.81 -29.55 42.01 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 121.872 1.715 . . . . 0.0 112.341 175.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 25.4 tp -65.48 -43.05 91.46 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.069 0.948 . . . . 0.0 111.583 176.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -60.49 -39.56 88.14 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 121.702 -0.624 . . . . 0.0 111.968 173.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -61.68 -43.28 99.16 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.244 0.618 . . . . 0.0 112.521 176.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 38.2 mtm -64.04 -49.83 70.84 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 173.059 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 65.7 mt -53.25 -48.16 68.46 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.886 1.274 . . . . 0.0 110.855 177.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.64 -18.51 12.38 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.745 1.618 . . . . 0.0 114.881 176.371 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -96.9 -22.51 16.84 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 125.955 1.702 . . . . 0.0 114.0 172.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -105.28 -26.98 11.79 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 119.818 1.19 . . . . 0.0 113.808 -175.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 3.0 tt -113.94 105.99 13.9 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.817 1.647 . . . . 0.0 106.937 169.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 44.9 t -61.31 125.23 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 C-N-CA 123.626 0.77 . . . . 0.0 110.405 -172.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 1.7 t -152.64 -174.33 4.87 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.597 1.159 . . . . 0.0 111.771 -177.119 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -75.44 -144.14 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.893 2.077 . . . . 0.0 110.594 171.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . 65.83 170.66 0.22 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 125.89 1.676 . . . . 0.0 115.306 -177.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 19.9 p . . . . . 0 N--CA 1.482 1.134 0 C-N-CA 127.124 2.17 . . . . 0.0 113.788 -177.457 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 200' ' ' 44Z . . . . . 0.43 ' CD3' ' CG1' ' A' ' 200' ' ' 44Z . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 21.8 pt20 . . . . . 0 CA--C 1.544 0.749 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -121.06 149.96 24.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 125.601 1.56 . . . . 0.0 110.222 -179.642 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -77.83 56.77 1.58 Allowed 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 124.991 1.317 . . . . 0.0 112.016 175.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -138.38 -179.4 5.78 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 128.092 2.557 . . . . 0.0 110.529 -170.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 23.6 m -103.73 156.29 5.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 124.759 1.224 . . . . 0.0 111.778 -176.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 30.8 ttt180 -101.31 123.24 45.41 Favored Pre-proline 0 N--CA 1.476 0.848 0 C-N-CA 124.651 1.181 . . . . 0.0 110.503 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.0 162.31 40.48 Favored 'Trans proline' 0 CA--C 1.535 0.553 0 C-N-CA 123.061 2.507 . . . . 0.0 113.197 170.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.3 tpmt? -61.38 150.42 35.3 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.476 1.11 . . . . 0.0 110.121 175.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 88.3 mt -60.73 -41.6 83.36 Favored Pre-proline 0 N--CA 1.478 0.936 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -170.28 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -65.09 -26.7 57.68 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 121.952 1.768 . . . . 0.0 114.02 172.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.2 tt -72.49 -45.91 57.24 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.06 0.944 . . . . 0.0 109.988 172.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.3 tt -57.79 -33.57 68.69 Favored 'General case' 0 N--CA 1.477 0.919 0 O-C-N 120.782 -1.199 . . . . 0.0 112.237 173.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.75 -28.14 69.76 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 113.742 1.015 . . . . 0.0 113.742 170.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 68.8 mt -67.33 -45.93 84.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 CA-C-N 119.74 1.155 . . . . 0.0 110.319 171.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.03 -40.66 90.08 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.275 0.63 . . . . 0.0 111.015 176.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.8 m170 -64.99 -42.74 94.25 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.758 -0.589 . . . . 0.0 112.51 173.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.34 -28.97 70.07 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.15 -0.969 . . . . 0.0 112.983 176.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.46 -6.08 44.1 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.428 1.091 . . . . 0.0 113.308 172.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.66 7.58 64.67 Favored Glycine 0 CA--C 1.537 1.464 0 C-N-CA 125.374 1.464 . . . . 0.0 115.129 -179.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -88.21 167.58 13.47 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 118.752 1.276 . . . . 0.0 112.745 177.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.8 tm0? -126.71 141.78 51.74 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.286 1.434 . . . . 0.0 109.551 169.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 174.92 167.5 34.29 Favored Glycine 0 N--CA 1.465 0.629 0 N-CA-C 114.726 0.65 . . . . 0.0 114.726 -178.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -126.8 -59.68 1.26 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.57 1.548 . . . . 0.0 109.734 170.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.0 mpp? -93.72 139.98 30.19 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 126.079 1.752 . . . . 0.0 111.126 170.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -146.53 138.97 25.08 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.425 1.49 . . . . 0.0 111.506 178.083 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 41.1 p -74.25 170.52 15.41 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 121.274 -0.891 . . . . 0.0 110.911 168.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.9 t -55.43 -40.53 58.39 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 120.349 -1.469 . . . . 0.0 110.891 169.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -66.96 -43.63 82.63 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.314 1.046 . . . . 0.0 112.695 179.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 64.6 mt-10 -69.79 -33.48 72.44 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 176.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 52.2 t -61.93 -54.87 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 CA-C-N 118.663 0.665 . . . . 0.0 109.49 169.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.3 ttm -61.75 -37.26 83.6 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 126.941 2.096 . . . . 0.0 114.586 -173.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -51.7 -55.19 21.01 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.154 0.582 . . . . 0.0 111.827 172.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 60.0 m-85 -74.82 -30.0 61.25 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 174.338 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -71.67 -39.65 70.15 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 120.277 1.399 . . . . 0.0 112.677 -179.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.16 -39.87 98.21 Favored Glycine 0 CA--C 1.533 1.202 0 CA-C-N 119.395 0.998 . . . . 0.0 111.959 171.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 9.9 tp60 -64.57 -45.74 85.78 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.023 1.329 . . . . 0.0 112.215 172.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -61.35 -49.54 76.55 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 124.21 1.004 . . . . 0.0 109.901 178.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 56.7 mt -64.38 -33.63 64.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 C-N-CA 124.322 1.049 . . . . 0.0 111.032 178.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 5.5 tpt -63.46 -39.23 93.9 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 120.23 1.377 . . . . 0.0 112.127 169.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 99.3 t -78.17 -41.53 26.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 O-C-N 120.429 -1.419 . . . . 0.0 112.584 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 52.7 mmtt -85.97 -15.71 40.66 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.082 1.353 . . . . 0.0 112.654 -176.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 48.02 81.29 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 128.558 2.743 . . . . 0.0 114.307 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 37.0 mt -101.86 8.71 41.17 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 125.194 1.398 . . . . 0.0 113.381 -177.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 50.3 p90 -122.58 164.02 18.94 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.325 1.85 . . . . 0.0 111.456 -175.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -91.32 133.46 35.41 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.79 -0.569 . . . . 0.0 111.369 174.232 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.2 -20.92 60.85 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 120.902 -1.124 . . . . 0.0 113.902 173.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -81.79 -32.03 31.53 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.543 1.137 . . . . 0.0 111.157 179.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -146.2 74.4 1.37 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 127.604 2.361 . . . . 0.0 110.311 -169.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 29.1 mp0 -60.41 -23.9 64.73 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 120.859 -1.151 . . . . 0.0 112.58 178.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 5.6 p-80 -67.4 -6.91 21.28 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.385 1.474 . . . . 0.0 114.502 171.065 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 1.9 tpt -111.98 126.77 55.5 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 126.749 2.02 . . . . 0.0 109.726 173.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.4 t -126.07 133.77 68.1 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.766 1.227 . . . . 0.0 110.062 -178.113 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -118.51 100.12 7.25 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.929 1.692 . . . . 0.0 109.086 173.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 61.4 m -99.43 14.51 29.51 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.509 0.724 . . . . 0.0 112.737 175.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.19 -27.25 68.77 Favored Glycine 0 CA--C 1.538 1.527 0 O-C-N 120.639 -1.288 . . . . 0.0 114.518 -177.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -90.03 4.61 83.17 Favored Glycine 0 CA--C 1.54 1.639 0 C-N-CA 125.145 1.355 . . . . 0.0 114.995 172.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -106.89 172.01 7.05 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.772 1.629 . . . . 0.0 112.669 -174.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 10.9 mp -53.45 -34.12 56.68 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.396 1.478 . . . . 0.0 112.663 169.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 98.7 mt -61.08 -47.15 87.67 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 121.111 -0.993 . . . . 0.0 111.654 170.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -63.3 -38.6 96.7 Favored Glycine 0 CA--C 1.533 1.171 0 CA-C-O 119.16 -0.8 . . . . 0.0 112.889 173.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.65 -29.66 62.47 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 119.715 1.758 . . . . 0.0 112.973 -179.497 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.1 pp -81.4 -34.72 31.45 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 175.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -100.4 -9.68 21.96 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 119.17 0.895 . . . . 0.0 113.15 -177.404 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.49 -27.1 3.33 Favored Glycine 0 CA--C 1.54 1.634 0 C-N-CA 125.525 1.536 . . . . 0.0 112.905 -169.298 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.68 138.36 6.05 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 128.032 2.533 . . . . 0.0 111.282 178.512 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -144.21 69.2 1.27 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.836 0.854 . . . . 0.0 109.149 168.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -105.02 124.88 50.3 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 169.421 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 49.8 p90 -157.22 156.03 31.85 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.18 0.992 . . . . 0.0 112.118 -169.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 10.5 m -107.65 135.8 48.48 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.076 171.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . 0.264 0.2 OUTLIER -78.23 -14.5 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 -169.412 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -75.5 -7.9 55.33 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 125.562 1.545 . . . . 0.0 114.832 174.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -116.67 95.35 45.97 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 126.719 2.008 . . . . 0.0 110.334 -172.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -62.45 -28.36 77.91 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.965 3.11 . . . . 0.0 115.249 -178.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 67.3 m -58.85 -53.89 61.84 Favored Pre-proline 0 N--CA 1.477 0.885 0 CA-C-N 120.121 1.328 . . . . 0.0 113.834 -178.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -65.52 -28.31 53.56 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 122.099 1.866 . . . . 0.0 113.187 174.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 49.4 mt -62.92 -50.89 69.07 Favored 'General case' 0 C--N 1.344 0.356 0 CA-C-N 119.6 1.091 . . . . 0.0 111.13 174.009 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -60.48 -40.84 92.76 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 118.883 -0.579 . . . . 0.0 112.146 174.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -61.46 -49.65 75.97 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 119.229 0.922 . . . . 0.0 112.845 179.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 31.4 mtm -60.78 -49.64 76.67 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.657 0.783 . . . . 0.0 112.211 175.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 10.2 mp -65.97 -42.38 89.96 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 118.542 -0.742 . . . . 0.0 111.814 -176.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -57.28 -20.27 27.0 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 119.835 1.198 . . . . 0.0 113.842 172.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 90.4 mttt -95.84 -13.87 23.68 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.77 1.628 . . . . 0.0 114.404 174.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 8.1 p-10 -124.8 -16.33 6.21 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 116.154 1.909 . . . . 0.0 116.154 -178.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 57.4 tp -119.86 137.7 53.84 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 127.358 2.263 . . . . 0.0 108.858 176.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 91.4 t -68.73 104.57 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 173.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 4.8 t -156.98 -179.56 8.34 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.722 1.609 . . . . 0.0 110.975 -178.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -97.29 160.43 14.33 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.743 1.217 . . . . 0.0 113.466 -172.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -101.57 174.97 5.72 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.817 2.047 . . . . 0.0 114.024 -169.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 13.0 t . . . . . 0 N--CA 1.483 1.218 0 C-N-CA 127.271 2.229 . . . . 0.0 114.865 177.817 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 200' ' ' 44Z . . . . . 0.45 ' CG1' ' CD3' ' A' ' 200' ' ' 44Z . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 . . . . . 0 CA--C 1.543 0.693 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.1 mt -130.31 14.89 2.22 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 125.052 1.341 . . . . 0.0 111.392 -175.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 49.46 39.02 15.69 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 126.115 1.766 . . . . 0.0 113.032 -175.446 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.1 pm0 -82.52 179.18 7.88 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.237 1.415 . . . . 0.0 113.708 -172.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 32.6 m -117.37 172.06 5.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 C-N-CA 126.744 2.017 . . . . 0.0 111.847 -175.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 24.0 ttp-105 -99.49 134.47 21.15 Favored Pre-proline 0 N--CA 1.481 1.111 0 O-C-N 120.847 -1.158 . . . . 0.0 111.802 178.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -71.46 171.29 16.51 Favored 'Trans proline' 0 C--N 1.354 0.832 0 C-N-CA 123.624 2.883 . . . . 0.0 112.65 175.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.6 tpmt? -62.01 146.66 49.52 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.251 1.02 . . . . 0.0 110.739 178.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 90.2 mt -55.3 -49.22 93.64 Favored Pre-proline 0 N--CA 1.474 0.769 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 -173.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -65.11 -21.09 63.22 Favored 'Trans proline' 0 CA--C 1.54 0.807 0 CA-C-N 122.034 1.762 . . . . 0.0 113.856 177.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.2 tt -75.72 -46.36 31.52 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.247 0.93 . . . . 0.0 109.657 169.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.1 tp -57.01 -34.62 68.36 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.246 -0.909 . . . . 0.0 113.285 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -64.3 -22.4 66.94 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 121.271 -0.893 . . . . 0.0 113.34 175.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 51.7 mt -70.23 -39.67 77.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 123.93 0.892 . . . . 0.0 110.363 171.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.9 mp -70.01 -35.37 74.31 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.347 -0.846 . . . . 0.0 111.279 175.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 57.7 m170 -61.03 -46.32 91.23 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 118.208 0.458 . . . . 0.0 111.263 169.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.65 -24.68 67.89 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 175.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.58 -6.31 39.81 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 172.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.72 17.59 47.98 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 125.039 1.304 . . . . 0.0 115.069 177.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -121.13 150.01 41.91 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.043 1.337 . . . . 0.0 112.71 -179.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -74.46 171.12 14.34 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.486 0.714 . . . . 0.0 111.548 169.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -169.06 133.1 2.74 Favored Glycine 0 C--N 1.341 0.817 0 N-CA-C 117.487 1.755 . . . . 0.0 117.487 -178.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -140.56 -13.41 0.99 Allowed 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 173.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 3.2 mtm -171.04 134.08 0.92 Allowed 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 126.539 1.936 . . . . 0.0 111.391 -175.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -155.1 147.5 24.0 Favored 'General case' 0 CA--C 1.55 0.974 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 -173.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 50.7 p -94.97 171.84 8.51 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 127.106 2.162 . . . . 0.0 110.371 168.234 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -52.09 -48.02 42.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 CA-C-N 120.356 1.435 . . . . 0.0 110.428 169.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -53.32 -37.84 62.65 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.114 0.966 . . . . 0.0 113.091 -179.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -80.82 -42.98 20.75 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.248 1.019 . . . . 0.0 112.726 176.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 75.6 t -64.18 -48.32 86.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 O-C-N 120.851 -1.156 . . . . 0.0 111.775 -179.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.4 mmm -72.66 -25.8 61.4 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 118.906 0.775 . . . . 0.0 112.421 -174.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 77.1 t60 -60.56 -54.52 44.44 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.678 0.791 . . . . 0.0 110.804 169.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 53.6 m-85 -72.37 -32.62 66.58 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 113.58 0.955 . . . . 0.0 113.58 179.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.9 mp -69.91 -40.64 75.48 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.882 1.219 . . . . 0.0 112.197 172.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.22 -42.91 99.72 Favored Glycine 0 CA--C 1.529 0.959 0 CA-C-N 118.979 0.809 . . . . 0.0 111.847 172.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.7 tp60 -58.52 -47.03 85.51 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.554 1.141 . . . . 0.0 111.973 171.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -60.7 -49.59 76.9 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.323 0.649 . . . . 0.0 110.752 175.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 54.6 mt -57.68 -37.83 61.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 124.868 1.267 . . . . 0.0 111.125 177.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -69.24 -37.56 78.05 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.876 0.87 . . . . 0.0 113.136 174.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 81.4 t -78.23 -31.5 16.34 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 124.179 0.992 . . . . 0.0 112.524 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 54.3 mmtt -92.34 -14.72 28.32 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.894 1.278 . . . . 0.0 113.152 176.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.7 mp0 53.61 61.16 3.24 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.467 1.907 . . . . 0.0 113.134 -172.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.4 mp -95.69 6.16 49.62 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.003 1.321 . . . . 0.0 113.539 -179.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 52.4 p90 -89.88 158.95 17.2 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.823 1.649 . . . . 0.0 110.691 169.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -85.27 123.37 30.67 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.589 -0.694 . . . . 0.0 110.904 170.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.4 -22.07 66.74 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 120.895 -1.128 . . . . 0.0 112.865 178.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 48.2 mm-40 -78.7 -26.94 44.92 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.357 -0.839 . . . . 0.0 111.035 -176.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -160.25 83.71 0.71 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 127.189 2.196 . . . . 0.0 110.906 -171.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -60.58 -14.24 18.96 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.626 1.57 . . . . 0.0 115.089 -169.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 22.6 p80 -65.31 -23.44 67.02 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 118.112 -0.947 . . . . 0.0 113.082 171.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 42.3 mmm -83.88 139.91 32.32 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 119.67 1.123 . . . . 0.0 112.843 173.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 60.4 t -120.86 133.45 67.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 127.794 2.437 . . . . 0.0 107.0 169.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 10.5 t80 -121.38 13.34 11.04 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 116.833 2.161 . . . . 0.0 116.833 -168.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 15.9 p 39.06 31.33 0.05 OUTLIER 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 128.407 2.683 . . . . 0.0 117.542 175.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.34 108.34 1.89 Allowed Glycine 0 CA--C 1.534 1.269 0 O-C-N 120.897 -1.127 . . . . 0.0 113.348 -171.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 68.45 14.06 66.29 Favored Glycine 0 CA--C 1.54 1.62 0 C-N-CA 124.21 0.91 . . . . 0.0 114.895 -175.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -75.45 155.27 36.45 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 118.682 1.241 . . . . 0.0 112.265 -177.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 81.8 mt -62.53 -32.5 73.46 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.412 1.485 . . . . 0.0 111.56 169.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 84.8 mt -54.81 -48.04 73.3 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.7 0.8 . . . . 0.0 111.354 171.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -71.78 -38.76 60.66 Favored Glycine 0 CA--C 1.53 0.976 0 C-N-CA 124.42 1.009 . . . . 0.0 112.989 178.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.93 -26.62 65.17 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 119.673 1.736 . . . . 0.0 112.481 177.457 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 47.7 tp -76.12 -56.32 4.76 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.397 1.479 . . . . 0.0 112.181 173.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.31 -7.73 41.01 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 113.469 0.915 . . . . 0.0 113.469 -169.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 80.66 -25.64 3.34 Favored Glycine 0 CA--C 1.539 1.558 0 C-N-CA 125.756 1.646 . . . . 0.0 113.34 -169.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.6 137.2 11.03 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 126.801 2.041 . . . . 0.0 112.058 178.264 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -148.14 49.06 1.05 Allowed 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.686 1.195 . . . . 0.0 110.429 168.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 8.1 p -89.85 137.53 32.26 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 121.327 -0.858 . . . . 0.0 110.063 169.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 46.6 p90 -171.82 167.95 6.2 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.519 0.728 . . . . 0.0 112.064 -169.151 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 60.2 p -121.21 143.83 48.93 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.071 -0.968 . . . . 0.0 113.51 173.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 27.1 m -74.39 -12.86 15.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 -179.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.39 -0.48 46.2 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.778 1.631 . . . . 0.0 114.586 170.5 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 40.8 t0 -126.85 77.39 74.65 Favored Pre-proline 0 CA--C 1.551 1.015 0 C-N-CA 127.135 2.174 . . . . 0.0 109.95 171.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_exo -56.64 -40.88 81.33 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 124.623 3.549 . . . . 0.0 114.882 -175.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 55.6 m -52.92 -54.86 39.24 Favored Pre-proline 0 N--CA 1.476 0.848 0 N-CA-C 114.838 1.421 . . . . 0.0 114.838 -172.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -65.81 -30.46 49.62 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 122.336 2.024 . . . . 0.0 113.425 175.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 37.0 tp -66.95 -47.28 72.13 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.003 0.921 . . . . 0.0 110.672 176.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -58.23 -40.53 81.93 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.721 0.808 . . . . 0.0 112.228 171.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -60.11 -51.04 71.31 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 119.729 1.15 . . . . 0.0 112.902 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 64.7 mtm -63.6 -44.5 93.8 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.034 0.534 . . . . 0.0 112.116 175.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 66.4 mt -61.5 -46.74 88.73 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-O 117.732 -1.128 . . . . 0.0 111.326 178.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 42.1 ttt180 -56.37 -24.98 47.9 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 121.265 1.848 . . . . 0.0 113.547 174.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -85.17 -17.9 35.77 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.561 1.544 . . . . 0.0 114.012 174.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -123.36 -6.39 8.22 Favored 'General case' 0 CA--C 1.558 1.273 0 N-CA-C 115.698 1.74 . . . . 0.0 115.698 178.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 68.8 tp -142.51 144.94 33.19 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 128.512 2.725 . . . . 0.0 109.679 -174.079 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 41.8 t -75.97 96.15 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 172.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 6.3 t -152.2 -174.62 4.94 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.404 1.482 . . . . 0.0 111.584 -177.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -101.52 175.58 5.52 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.467 1.907 . . . . 0.0 112.395 -171.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -109.13 -169.55 1.5 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.839 1.656 . . . . 0.0 112.999 -177.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 54.4 p . . . . . 0 N--CA 1.475 0.785 0 C-N-CA 126.137 1.775 . . . . 0.0 113.66 177.023 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 200' ' ' 44Z . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 . . . . . 0 CA--C 1.543 0.706 0 N-CA-C 112.292 0.478 . . . . 0.0 112.292 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 50.9 mt -129.09 136.95 58.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 125.408 1.483 . . . . 0.0 110.492 -175.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.0 t30 -112.0 123.39 50.16 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.456 1.502 . . . . 0.0 108.856 169.334 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.1 pm0 -147.2 -179.68 7.0 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 -168.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 33.7 m -104.14 172.18 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 C-N-CA 127.126 2.17 . . . . 0.0 111.656 175.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.3 ttp-105 -95.42 133.66 25.55 Favored Pre-proline 0 N--CA 1.48 1.037 0 O-C-N 120.991 -1.068 . . . . 0.0 111.522 172.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -68.38 171.44 12.88 Favored 'Trans proline' 0 C--N 1.354 0.857 0 C-N-CA 123.799 3.0 . . . . 0.0 113.501 176.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.5 ttmt -62.86 149.62 43.9 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.142 0.977 . . . . 0.0 110.685 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 81.3 mt -61.66 -43.11 87.12 Favored Pre-proline 0 N--CA 1.476 0.866 0 N-CA-C 115.062 1.504 . . . . 0.0 115.062 -168.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -65.0 -28.41 57.66 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.035 1.824 . . . . 0.0 113.752 172.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 5.1 tt -67.49 -49.19 64.63 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 119.221 0.919 . . . . 0.0 109.499 172.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 13.9 tp -60.24 -33.07 71.77 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 121.294 -0.879 . . . . 0.0 112.784 177.41 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -58.66 -27.69 65.02 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 174.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 60.0 mt -72.99 -39.13 57.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.17 0.988 . . . . 0.0 110.998 175.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.3 mp -68.08 -34.85 77.19 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.477 -0.764 . . . . 0.0 110.953 174.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 60.4 m170 -61.94 -44.58 96.47 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 121.998 -0.439 . . . . 0.0 111.513 169.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -65.02 -26.99 68.51 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 175.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.33 -3.41 26.97 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.352 1.061 . . . . 0.0 113.435 171.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.67 15.26 57.02 Favored Glycine 0 CA--C 1.535 1.317 0 C-N-CA 125.021 1.296 . . . . 0.0 115.309 174.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -117.13 145.34 43.86 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.943 1.297 . . . . 0.0 112.551 -179.114 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -75.06 170.69 15.51 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.255 0.622 . . . . 0.0 111.329 169.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -173.0 143.74 7.44 Favored Glycine 0 C--N 1.34 0.765 0 N-CA-C 117.324 1.69 . . . . 0.0 117.324 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -140.7 -11.22 1.02 Allowed 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 175.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.5 mtm -169.68 130.18 1.03 Allowed 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 125.744 1.618 . . . . 0.0 111.579 -175.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -155.82 139.5 16.06 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -175.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 64.8 p -80.77 176.02 10.17 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.792 0.837 . . . . 0.0 109.646 166.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -59.34 -37.64 70.41 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.324 0 O-C-N 120.262 -1.524 . . . . 0.0 111.651 172.381 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -66.97 -42.19 85.57 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.865 1.666 . . . . 0.0 113.059 175.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -70.34 -35.06 73.36 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.776 -0.577 . . . . 0.0 112.094 174.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 18.7 t -60.38 -48.91 86.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 124.085 0.954 . . . . 0.0 110.844 169.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -62.34 -36.43 82.16 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 127.097 2.159 . . . . 0.0 114.178 -173.176 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -51.7 -53.02 43.74 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 122.857 0.463 . . . . 0.0 111.956 170.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -74.7 -31.66 61.94 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 114.296 1.221 . . . . 0.0 114.296 175.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -72.14 -41.93 66.58 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.971 1.26 . . . . 0.0 112.876 -179.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -60.46 -42.94 99.22 Favored Glycine 0 CA--C 1.532 1.126 0 CA-C-N 118.826 0.739 . . . . 0.0 111.559 171.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.2 tp60 -61.61 -42.26 98.63 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.77 1.228 . . . . 0.0 112.648 173.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -64.45 -51.88 60.83 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.307 1.043 . . . . 0.0 110.42 177.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 55.8 mt -60.85 -37.4 76.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 O-C-N 121.501 -0.749 . . . . 0.0 110.597 179.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.2 tpt -63.88 -46.57 84.33 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.88 1.272 . . . . 0.0 112.892 173.59 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.3 p -78.5 -27.24 14.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 CA-C-N 119.73 1.15 . . . . 0.0 113.683 -176.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 55.0 mmtt -90.48 -15.72 30.27 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 125.074 1.349 . . . . 0.0 113.365 173.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.4 mp0 54.35 60.08 3.79 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 127.034 2.134 . . . . 0.0 113.105 -174.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.9 tp -95.62 6.18 49.6 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.08 0.952 . . . . 0.0 113.301 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 47.4 p90 -95.68 159.8 14.81 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 126.109 1.763 . . . . 0.0 111.022 173.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -86.07 129.24 34.9 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.518 -0.739 . . . . 0.0 111.836 172.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.35 -24.26 66.48 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 120.799 -1.188 . . . . 0.0 112.752 176.536 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 49.7 mm-40 -78.68 -30.57 46.23 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.28 -0.887 . . . . 0.0 110.756 -176.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -151.72 80.58 1.28 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 128.036 2.534 . . . . 0.0 110.159 -169.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 27.2 mp0 -60.76 -15.54 30.67 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 114.292 1.219 . . . . 0.0 114.292 -174.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 21.6 p80 -64.31 -22.51 66.98 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 118.402 -0.809 . . . . 0.0 113.113 171.548 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.8 ttm -96.88 137.27 36.23 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 119.838 1.199 . . . . 0.0 112.783 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 52.7 t -132.06 138.32 52.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 126.419 1.888 . . . . 0.0 110.18 -179.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -104.16 51.02 0.78 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.934 1.293 . . . . 0.0 113.889 -171.007 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 90.4 m -69.39 -1.61 8.82 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 115.321 1.6 . . . . 0.0 115.321 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.36 -25.19 60.1 Favored Glycine 0 CA--C 1.539 1.578 0 CA-C-N 120.462 1.483 . . . . 0.0 113.686 169.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -91.57 9.96 75.84 Favored Glycine 0 CA--C 1.54 1.653 0 C-N-CA 125.506 1.526 . . . . 0.0 115.064 170.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -119.6 174.83 6.17 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.539 1.536 . . . . 0.0 112.689 -173.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -49.84 -40.17 41.32 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.004 1.722 . . . . 0.0 111.933 176.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 63.1 mt -62.56 -38.12 88.83 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 120.746 0.307 . . . . 0.0 111.155 178.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -79.12 -29.09 52.16 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 125.381 1.467 . . . . 0.0 113.593 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -67.47 -42.23 83.33 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 120.491 2.145 . . . . 0.0 109.606 169.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 24.1 tp -60.66 -48.46 81.69 Favored 'General case' 0 CA--C 1.552 1.023 0 CA-C-N 114.974 -1.012 . . . . 0.0 112.76 177.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 8.1 mt -94.17 -7.39 42.42 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 116.044 1.868 . . . . 0.0 116.044 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.81 -16.33 11.93 Favored Glycine 0 CA--C 1.543 1.836 0 O-C-N 120.701 -1.249 . . . . 0.0 113.797 -169.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.23 155.35 26.88 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 129.024 2.93 . . . . 0.0 109.322 173.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -164.03 25.57 0.07 Allowed 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 119.229 0.922 . . . . 0.0 112.215 169.294 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 17.2 m -84.97 132.01 34.41 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 120.999 -1.063 . . . . 0.0 108.681 175.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 6.3 p90 -161.26 178.57 9.11 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 -167.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 96.7 p -122.88 137.67 54.87 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 114.423 -1.262 . . . . 0.0 113.314 173.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 15.3 m -73.74 -17.05 17.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 -173.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.7 pttt -82.53 -6.31 59.25 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.039 1.736 . . . . 0.0 115.046 -177.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -118.73 83.33 22.1 Favored Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 126.119 1.768 . . . . 0.0 110.585 -173.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.28 -30.69 54.1 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 124.083 3.189 . . . . 0.0 115.315 -169.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 66.9 m -61.72 -53.96 55.95 Favored Pre-proline 0 N--CA 1.475 0.817 0 CA-C-N 119.698 1.136 . . . . 0.0 113.995 -176.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -69.37 -28.38 27.18 Favored 'Trans proline' 0 C--N 1.354 0.818 0 C-N-CA 121.869 1.713 . . . . 0.0 112.764 175.109 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 18.7 tp -66.77 -44.51 81.19 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.884 1.274 . . . . 0.0 111.914 179.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -55.48 -39.09 69.98 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.8 1.24 . . . . 0.0 112.947 176.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -59.7 -47.18 86.67 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.717 0.807 . . . . 0.0 112.396 177.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 16.7 mtm -69.21 -41.85 76.54 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 178.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 65.9 mt -55.34 -54.96 37.06 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.441 1.096 . . . . 0.0 110.588 175.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 72.7 ttt180 -52.44 -31.97 37.17 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.247 1.419 . . . . 0.0 113.223 178.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -78.78 -29.57 45.1 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.272 1.429 . . . . 0.0 113.757 176.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 31.3 m-20 -109.74 -19.16 13.26 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -171.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 47.7 tp -117.37 103.26 9.96 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.218 1.807 . . . . 0.0 106.436 168.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 12.2 p -60.3 116.22 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 CA-C-O 121.423 0.63 . . . . 0.0 111.88 -172.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 6.0 t -161.97 168.64 22.5 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.215 1.406 . . . . 0.0 111.426 -179.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -93.0 177.59 6.02 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.635 1.574 . . . . 0.0 114.109 175.721 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -135.58 157.28 47.28 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.43 1.892 . . . . 0.0 112.293 -172.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 73.1 p . . . . . 0 N--CA 1.485 1.284 0 C-N-CA 127.04 2.136 . . . . 0.0 114.417 176.609 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 200' ' ' 44Z . . . . . 0.418 ' CD3' ' CG1' ' A' ' 200' ' ' 44Z . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 . . . . . 0 CA--C 1.545 0.768 0 CA-C-O 121.992 0.901 . . . . 0.0 112.924 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.4 pp -86.09 -3.04 8.36 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 C-N-CA 127.143 2.177 . . . . 0.0 115.803 -170.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 57.7 t30 55.2 8.11 0.24 Allowed 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 127.813 2.445 . . . . 0.0 116.528 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.64 176.37 8.22 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.741 2.016 . . . . 0.0 111.617 178.235 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.4 m -104.19 172.08 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.175 0 C-N-CA 126.207 1.803 . . . . 0.0 112.684 -177.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.1 ttp-105 -87.59 138.53 31.69 Favored Pre-proline 0 N--CA 1.481 1.094 0 C-N-CA 125.175 1.39 . . . . 0.0 111.814 178.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -73.89 177.75 7.73 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 123.959 3.106 . . . . 0.0 113.71 175.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 32.1 ttmt -69.86 155.21 40.9 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.456 1.102 . . . . 0.0 111.296 179.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 68.4 mt -56.25 -45.71 99.88 Favored Pre-proline 0 CA--C 1.544 0.726 0 N-CA-C 116.346 1.98 . . . . 0.0 116.346 -168.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -64.19 -29.46 64.62 Favored 'Trans proline' 0 C--N 1.351 0.693 0 CA-C-N 122.152 1.804 . . . . 0.0 113.262 175.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.3 tt -71.27 -42.53 68.64 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.068 0.849 . . . . 0.0 110.14 176.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 11.5 tp -58.57 -37.15 75.14 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.514 -0.741 . . . . 0.0 111.408 170.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.7 -37.09 85.5 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.146 0.979 . . . . 0.0 113.432 175.262 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 87.8 mt -62.57 -44.53 99.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 CA-C-N 119.043 0.838 . . . . 0.0 110.973 170.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 71.2 mt -62.39 -37.54 86.15 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.529 0.732 . . . . 0.0 111.857 175.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -63.43 -45.28 91.66 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 121.195 -0.941 . . . . 0.0 112.368 169.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.62 -27.06 68.97 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.017 0.927 . . . . 0.0 113.085 177.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.49 -7.29 46.57 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.352 1.061 . . . . 0.0 113.447 173.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 93.18 8.6 61.33 Favored Glycine 0 CA--C 1.537 1.447 0 C-N-CA 125.537 1.541 . . . . 0.0 114.952 -178.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -97.62 173.94 6.89 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.891 1.276 . . . . 0.0 113.062 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 15.5 tp60 -129.51 149.19 51.39 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 126.511 1.924 . . . . 0.0 108.92 169.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -158.68 148.92 18.73 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 116.421 1.328 . . . . 0.0 116.421 -174.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -133.41 -14.77 2.54 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.973 1.309 . . . . 0.0 113.829 174.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 6.0 mtm -175.41 137.18 0.37 Allowed 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 129.231 3.012 . . . . 0.0 109.367 -178.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -158.54 170.21 22.7 Favored 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 114.317 1.228 . . . . 0.0 114.317 174.062 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 70.5 p -90.44 171.62 9.3 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 126.295 1.838 . . . . 0.0 112.131 173.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.8 t -51.56 -44.08 33.19 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 123.634 0.774 . . . . 0.0 110.761 169.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -67.69 -42.86 81.4 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 125.155 1.382 . . . . 0.0 112.89 -179.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -72.52 -32.68 66.32 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 118.433 0.56 . . . . 0.0 112.469 179.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 43.7 t -63.87 -49.28 82.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 123.459 0.703 . . . . 0.0 109.703 169.155 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -65.22 -34.0 77.33 Favored 'General case' 0 N--CA 1.458 -0.072 0 C-N-CA 126.871 2.069 . . . . 0.0 114.301 -176.3 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -51.56 -52.9 43.38 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.543 0.737 . . . . 0.0 111.257 172.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -74.78 -32.83 62.15 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.896 1.443 . . . . 0.0 114.896 172.065 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.67 -41.41 75.54 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 120.674 1.579 . . . . 0.0 113.053 -178.507 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.27 -39.75 98.21 Favored Glycine 0 CA--C 1.533 1.178 0 CA-C-N 118.678 0.672 . . . . 0.0 111.817 173.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.5 tp60 -62.8 -45.33 93.16 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.786 1.234 . . . . 0.0 112.045 172.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -60.76 -49.71 76.41 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.896 0.879 . . . . 0.0 110.426 177.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 53.3 mt -62.21 -34.98 66.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 C-N-CA 124.019 0.928 . . . . 0.0 111.236 177.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.76 -38.61 91.58 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 119.575 1.08 . . . . 0.0 112.358 172.102 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 96.5 t -78.28 -34.76 18.88 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 C-N-CA 124.334 1.053 . . . . 0.0 112.998 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 19.0 mmtp -90.16 -14.94 32.51 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.961 1.304 . . . . 0.0 113.328 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.2 mp0 47.34 62.2 2.53 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 127.269 2.228 . . . . 0.0 113.876 -172.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 31.6 mt -82.66 -13.11 57.03 Favored 'General case' 0 N--CA 1.478 0.974 0 O-C-N 121.306 -0.871 . . . . 0.0 112.548 175.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 44.5 p90 -78.69 152.47 31.59 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.045 0.938 . . . . 0.0 111.744 176.12 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -83.41 127.2 33.49 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 121.834 -0.541 . . . . 0.0 110.619 169.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -65.8 -24.47 66.92 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.1 -1.0 . . . . 0.0 113.515 -176.654 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -85.5 -30.08 23.73 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-O 121.385 0.612 . . . . 0.0 111.337 -171.117 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -148.54 87.82 1.6 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 128.587 2.755 . . . . 0.0 110.064 178.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 29.2 mp0 -61.2 -14.24 24.03 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 -172.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 23.9 p80 -61.74 -30.76 70.99 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 118.278 -0.868 . . . . 0.0 112.378 170.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 21.5 tpp -83.07 128.53 34.57 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 119.781 1.173 . . . . 0.0 111.036 177.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 3.3 t -120.91 122.49 67.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 C-N-CA 126.106 1.762 . . . . 0.0 108.857 174.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -107.49 107.09 17.79 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.509 1.524 . . . . 0.0 109.796 178.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 84.2 m -99.8 20.04 14.91 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.253 1.021 . . . . 0.0 113.27 -177.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.69 122.98 31.85 Favored Glycine 0 CA--C 1.534 1.264 0 O-C-N 120.937 -1.102 . . . . 0.0 111.872 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 78.27 0.4 77.52 Favored Glycine 0 CA--C 1.54 1.65 0 C-N-CA 124.488 1.042 . . . . 0.0 115.374 -174.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -80.72 162.77 23.97 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 119.278 1.539 . . . . 0.0 111.657 171.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -46.47 -40.81 12.99 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.623 1.569 . . . . 0.0 111.743 170.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 97.1 mt -60.18 -43.66 95.68 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.088 0.955 . . . . 0.0 111.998 176.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -71.49 -34.15 63.62 Favored Glycine 0 CA--C 1.533 1.19 0 C-N-CA 124.99 1.281 . . . . 0.0 114.061 176.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -66.85 -42.64 85.4 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 120.637 2.219 . . . . 0.0 110.487 174.061 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 27.1 tp -61.51 -52.65 63.59 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 115.085 -0.961 . . . . 0.0 112.456 177.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -101.91 -6.8 23.06 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -169.568 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.86 -29.22 2.41 Favored Glycine 0 CA--C 1.54 1.651 0 O-C-N 120.349 -1.469 . . . . 0.0 112.805 -169.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.84 135.86 7.65 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 127.633 2.373 . . . . 0.0 111.926 179.012 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 11.6 mt-30 -142.38 45.84 1.62 Allowed 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.29 1.036 . . . . 0.0 109.831 168.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 1.6 m -86.33 128.41 34.92 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 121.161 -0.962 . . . . 0.0 109.184 169.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 17.8 p90 -158.02 168.63 26.59 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.496 0.718 . . . . 0.0 112.856 -169.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 34.6 t -118.61 138.04 52.85 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.828 170.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -77.53 -1.43 3.86 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 12.6 pttp -84.29 -7.81 59.22 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.565 1.146 . . . . 0.0 113.702 169.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -122.89 83.25 49.92 Favored Pre-proline 0 CA--C 1.55 0.981 0 C-N-CA 126.487 1.915 . . . . 0.0 110.819 -170.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -67.46 -27.88 39.28 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.88 3.054 . . . . 0.0 115.269 -170.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 59.6 m -61.79 -53.71 57.97 Favored Pre-proline 0 N--CA 1.477 0.902 0 CA-C-N 119.867 1.212 . . . . 0.0 114.192 -177.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -67.21 -29.98 38.35 Favored 'Trans proline' 0 C--N 1.353 0.777 0 C-N-CA 121.93 1.753 . . . . 0.0 112.636 175.225 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 27.9 tp -65.35 -44.14 88.64 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.408 1.083 . . . . 0.0 111.551 177.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 25.7 t80 -60.43 -36.39 78.07 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.865 1.266 . . . . 0.0 112.195 174.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -65.47 -47.17 77.03 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.664 0.785 . . . . 0.0 112.712 175.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 31.1 mtm -57.59 -49.66 75.68 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.024 0.53 . . . . 0.0 111.768 174.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 7.5 mp -63.11 -47.89 80.86 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-O 117.294 -1.336 . . . . 0.0 111.125 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 61.7 mtp180 -52.0 -29.65 21.73 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-N 121.067 1.758 . . . . 0.0 113.757 175.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -85.82 -20.21 29.5 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.594 1.557 . . . . 0.0 114.879 177.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -126.69 -25.64 3.36 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 115.29 1.589 . . . . 0.0 115.29 -174.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 44.7 tp -118.63 95.71 4.97 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 127.619 2.368 . . . . 0.0 107.179 170.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 12.9 p -59.57 125.54 15.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 CA-C-O 121.869 0.842 . . . . 0.0 112.718 -169.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 13.2 t -159.96 166.21 30.53 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 126.436 1.894 . . . . 0.0 110.248 -176.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -77.07 169.45 18.32 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.416 1.087 . . . . 0.0 113.521 178.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -115.04 160.46 19.59 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.032 1.733 . . . . 0.0 113.084 -169.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 27.3 p . . . . . 0 N--CA 1.483 1.223 0 C-N-CA 127.026 2.13 . . . . 0.0 113.995 178.475 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 200' ' ' 44Z . . . . . 0.448 ' CG1' ' CD3' ' A' ' 200' ' ' 44Z . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 . . . . . 0 CA--C 1.544 0.712 0 CA-C-O 121.015 0.435 . . . . 0.0 112.152 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 46.5 mm -78.28 129.43 37.52 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 123.874 0.869 . . . . 0.0 111.981 -175.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 66.8 t30 -134.88 -8.37 2.38 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 126.637 1.975 . . . . 0.0 112.565 169.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 17.8 pm0 -82.81 172.9 12.36 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 128.728 2.811 . . . . 0.0 112.625 177.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 34.8 m -104.14 172.31 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 126.599 1.96 . . . . 0.0 112.103 178.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.4 ptt-85 -94.29 156.98 38.25 Favored Pre-proline 0 N--CA 1.488 1.425 0 C-N-CA 124.65 1.18 . . . . 0.0 112.015 169.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -68.06 176.43 5.41 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 123.839 3.026 . . . . 0.0 112.756 169.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 24.4 ttmt -65.11 148.06 52.35 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.136 0.974 . . . . 0.0 111.2 179.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 81.8 mt -53.4 -50.74 81.15 Favored Pre-proline 0 N--CA 1.477 0.914 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -169.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -64.43 -22.07 65.96 Favored 'Trans proline' 0 CA--C 1.54 0.777 0 C-N-CA 122.262 1.975 . . . . 0.0 114.142 175.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.1 tt -77.9 -37.51 47.81 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 119.825 1.193 . . . . 0.0 110.54 169.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 16.2 tp -58.58 -35.09 71.86 Favored 'General case' 0 N--CA 1.475 0.775 0 O-C-N 120.765 -1.209 . . . . 0.0 112.264 171.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.426 ' HA ' ' HE2' ' A' ' 35' ' ' LYS . 9.0 mmpt? -59.84 -26.62 65.96 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 172.131 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 81.8 mt -73.04 -36.98 52.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 123.977 0.911 . . . . 0.0 110.662 176.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.4 mp -70.51 -34.3 72.17 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.152 -0.967 . . . . 0.0 111.279 172.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 43.6 m170 -63.15 -42.44 99.44 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.796 -0.565 . . . . 0.0 111.532 169.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.79 -28.54 69.94 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.153 0.981 . . . . 0.0 113.166 173.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.54 -6.51 36.87 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 124.153 0.981 . . . . 0.0 113.33 171.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 92.47 16.54 49.14 Favored Glycine 0 CA--C 1.535 1.344 0 C-N-CA 125.309 1.433 . . . . 0.0 115.142 177.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -123.76 139.99 53.43 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 118.77 1.285 . . . . 0.0 113.421 -176.316 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -77.04 151.86 35.36 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.164 0.986 . . . . 0.0 110.192 169.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -165.32 146.89 11.64 Favored Glycine 0 CA--C 1.527 0.834 0 N-CA-C 115.221 0.848 . . . . 0.0 115.221 176.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -137.58 -14.03 1.48 Allowed 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 114.687 1.365 . . . . 0.0 114.687 -175.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 5.9 mtm -176.45 126.35 0.19 Allowed 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 128.44 2.696 . . . . 0.0 109.658 -176.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -170.42 152.03 3.89 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 114.507 1.299 . . . . 0.0 114.507 176.572 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 42.9 p -75.41 175.32 8.55 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 126.351 1.861 . . . . 0.0 113.163 176.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 8.9 t -54.54 -50.1 61.29 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 O-C-N 120.614 -1.304 . . . . 0.0 110.401 169.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -56.43 -37.37 70.12 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.287 0.949 . . . . 0.0 112.587 -177.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -79.23 -30.79 43.38 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.687 1.195 . . . . 0.0 113.474 176.013 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 49.6 t -75.28 -46.05 39.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.124 0.97 . . . . 0.0 111.777 176.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.423 ' SD ' ' CD2' ' A' ' 200' ' ' 44Z . 29.4 mmt -62.36 -26.81 68.66 Favored 'General case' 0 N--CA 1.483 1.221 0 CA-C-N 119.907 1.231 . . . . 0.0 113.116 -177.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -51.56 -52.95 43.04 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.18 170.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -74.88 -36.99 62.25 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 170.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -75.18 -41.47 57.94 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 120.831 -1.168 . . . . 0.0 112.898 -171.578 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -64.11 -35.92 92.59 Favored Glycine 0 CA--C 1.531 1.052 0 O-C-N 121.654 -0.654 . . . . 0.0 111.814 171.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 9.1 tp60 -64.48 -44.55 90.65 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.679 1.191 . . . . 0.0 111.912 171.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -60.21 -48.84 80.04 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.637 0.775 . . . . 0.0 110.364 175.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 58.1 mt -63.04 -35.27 70.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 124.108 0.963 . . . . 0.0 111.241 177.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.0 tpt -65.57 -35.7 81.62 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.447 1.099 . . . . 0.0 112.516 173.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 64.0 t -78.35 -47.74 23.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 O-C-N 120.848 -1.158 . . . . 0.0 112.29 175.11 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 18.2 mmtp -80.62 -13.43 59.05 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.52 1.128 . . . . 0.0 112.624 -174.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 51.79 63.95 2.04 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 127.901 2.48 . . . . 0.0 113.434 176.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 37.1 mt -86.6 -11.27 51.93 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.726 0.81 . . . . 0.0 112.729 178.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 45.4 p90 -84.73 154.61 22.33 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.208 1.003 . . . . 0.0 111.632 175.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -88.42 129.15 35.5 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 169.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.75 -31.02 57.97 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 113.876 1.065 . . . . 0.0 113.876 179.23 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -93.91 -17.71 22.71 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.721 1.209 . . . . 0.0 112.702 -172.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -140.84 64.01 1.44 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.837 2.455 . . . . 0.0 109.677 -177.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -62.96 -18.06 62.75 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 -171.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 27.7 p80 -61.1 -32.03 71.71 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.624 0.77 . . . . 0.0 112.761 169.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 7.1 ttm -89.26 136.78 32.83 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.516 1.126 . . . . 0.0 112.021 178.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 3.6 t -122.19 126.58 74.52 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 C-N-CA 125.906 1.682 . . . . 0.0 108.3 172.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -106.22 101.43 10.91 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.396 1.078 . . . . 0.0 109.929 178.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 13.7 m -101.28 9.52 41.66 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.673 0.789 . . . . 0.0 112.976 -179.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.87 -27.92 65.12 Favored Glycine 0 CA--C 1.54 1.646 0 O-C-N 120.912 -1.118 . . . . 0.0 114.169 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -94.13 7.09 72.75 Favored Glycine 0 CA--C 1.541 1.674 0 C-N-CA 125.527 1.537 . . . . 0.0 115.07 171.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -105.97 167.24 9.93 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.109 1.764 . . . . 0.0 112.3 -176.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -46.43 -43.33 16.37 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 126.22 1.808 . . . . 0.0 111.7 169.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 81.0 mt -60.24 -39.86 88.21 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.135 0.574 . . . . 0.0 112.44 176.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -69.65 -37.98 77.55 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 124.573 1.082 . . . . 0.0 113.784 174.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -63.77 -42.73 97.75 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 120.133 1.966 . . . . 0.0 110.897 173.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 29.6 tp -62.06 -49.08 77.42 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 126.096 1.758 . . . . 0.0 112.85 179.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -105.28 -6.85 19.33 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.707 1.203 . . . . 0.0 113.521 -171.105 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 78.66 -30.06 2.0 Favored Glycine 0 CA--C 1.54 1.643 0 O-C-N 120.254 -1.529 . . . . 0.0 113.564 -169.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.94 132.03 9.98 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 127.942 2.497 . . . . 0.0 110.414 176.629 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -144.4 35.03 1.18 Allowed 'General case' 0 N--CA 1.476 0.843 0 CA-C-O 121.901 0.858 . . . . 0.0 110.426 176.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.2 m -99.0 139.37 34.74 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.381 0.673 . . . . 0.0 111.178 179.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 53.9 p90 -163.56 177.24 8.96 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.801 1.24 . . . . 0.0 112.77 -168.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 29.8 t -128.47 141.22 51.46 Favored 'General case' 0 CA--C 1.52 -0.208 0 C-N-CA 124.37 1.068 . . . . 0.0 110.921 168.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 22.7 m -72.25 -9.95 13.45 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 177.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 43.8 pttt -77.11 -10.86 59.66 Favored 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 169.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 44.0 t0 -123.4 77.45 53.9 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 126.431 1.893 . . . . 0.0 109.615 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -70.0 -25.73 27.19 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 123.406 2.737 . . . . 0.0 114.954 -169.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 49.4 m -61.28 -53.47 62.46 Favored Pre-proline 0 N--CA 1.476 0.834 0 CA-C-N 119.867 1.212 . . . . 0.0 114.119 -177.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -66.05 -32.13 44.62 Favored 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.081 1.854 . . . . 0.0 113.011 176.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 39.1 tp -63.4 -51.49 65.57 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.63 1.172 . . . . 0.0 110.079 175.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 68.4 t80 -54.75 -45.92 74.26 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.437 1.095 . . . . 0.0 112.281 171.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -65.27 -35.81 82.17 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 114.077 1.139 . . . . 0.0 114.077 -175.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 55.1 mtm -68.85 -49.78 55.42 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 120.925 0.393 . . . . 0.0 111.401 169.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.2 mp -61.11 -29.59 69.85 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 124.805 1.242 . . . . 0.0 112.463 -179.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 13.7 ttm-85 -52.12 -28.4 17.68 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.701 1.6 . . . . 0.0 113.173 169.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -88.4 -23.41 23.34 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.496 1.518 . . . . 0.0 114.153 173.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 27.0 m120 -123.9 -22.54 4.85 Favored 'General case' 0 N--CA 1.486 1.364 0 N-CA-C 117.141 2.275 . . . . 0.0 117.141 -169.154 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 60.0 tp -129.23 154.48 46.76 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.641 1.976 . . . . 0.0 111.588 -169.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 11.7 p -61.37 125.94 18.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 O-C-N 121.632 -0.668 . . . . 0.0 111.048 173.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 3.4 t -159.7 -174.49 4.64 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.625 1.17 . . . . 0.0 111.71 -177.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -78.17 17.78 0.59 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.698 1.999 . . . . 0.0 115.292 -169.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -154.04 146.72 24.21 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.66 1.584 . . . . 0.0 111.842 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 66.8 p . . . . . 0 N--CA 1.484 1.251 0 C-N-CA 127.342 2.257 . . . . 0.0 114.759 174.348 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 200' ' ' 44Z . . . . . 0.423 ' CD2' ' SD ' ' A' ' 53' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 53.3 mm-40 . . . . . 0 CA--C 1.542 0.67 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.3 mt -136.26 151.84 29.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 125.885 1.674 . . . . 0.0 109.581 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -120.12 76.3 1.16 Allowed 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.311 1.444 . . . . 0.0 110.169 174.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 7.8 mp0 -79.5 175.08 10.93 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.584 1.154 . . . . 0.0 113.612 -172.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.8 m -104.13 170.43 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 126.503 1.921 . . . . 0.0 111.62 174.09 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 44.9 ttp180 -104.99 136.74 19.12 Favored Pre-proline 0 N--CA 1.479 0.976 0 C-N-CA 124.711 1.204 . . . . 0.0 110.994 177.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -75.99 177.93 8.1 Favored 'Trans proline' 0 CA--C 1.537 0.629 0 C-N-CA 123.171 2.581 . . . . 0.0 112.331 171.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.5 ttmt -63.0 148.26 48.21 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.686 0.794 . . . . 0.0 110.219 176.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 85.3 mt -58.17 -43.17 98.09 Favored Pre-proline 0 N--CA 1.475 0.811 0 N-CA-C 114.74 1.385 . . . . 0.0 114.74 -169.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -64.45 -27.24 62.48 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 CA-C-N 122.581 1.958 . . . . 0.0 114.04 174.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.9 tt -70.11 -38.84 75.7 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 120.914 -1.116 . . . . 0.0 110.014 171.079 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.9 tp -60.12 -38.63 83.6 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 121.264 -0.898 . . . . 0.0 111.808 170.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.403 ' HA ' ' HE2' ' A' ' 35' ' ' LYS . 8.8 mmpt? -64.05 -40.85 97.19 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.769 0.828 . . . . 0.0 112.429 173.034 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 76.0 mt -62.93 -40.31 88.44 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 124.658 1.183 . . . . 0.0 111.624 175.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 77.6 mt -64.0 -40.71 96.98 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 121.053 -1.03 . . . . 0.0 112.846 170.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 51.4 m170 -60.43 -43.99 96.23 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 119.241 0.928 . . . . 0.0 111.688 171.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -65.64 -25.57 67.42 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.504 1.121 . . . . 0.0 113.059 179.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.74 -4.42 34.4 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 123.988 0.915 . . . . 0.0 113.442 172.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.35 9.17 65.4 Favored Glycine 0 CA--C 1.536 1.367 0 C-N-CA 125.298 1.428 . . . . 0.0 114.8 -179.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -98.51 144.93 27.3 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.662 1.185 . . . . 0.0 112.277 179.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.6 tp60 -73.77 136.46 43.61 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 121.456 -0.778 . . . . 0.0 109.626 169.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -110.5 93.06 0.71 Allowed Glycine 0 CA--C 1.522 0.517 0 N-CA-C 114.317 0.487 . . . . 0.0 114.317 -172.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -146.85 73.64 1.32 Allowed 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.532 1.533 . . . . 0.0 109.939 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 25.7 mtm 65.35 134.31 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 129.77 3.228 . . . . 0.0 117.082 171.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -163.45 163.35 24.89 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 114.052 1.131 . . . . 0.0 114.052 -170.141 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 31.9 p -78.01 170.99 15.68 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.077 1.351 . . . . 0.0 112.458 172.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -53.32 -41.74 45.03 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 O-C-N 121.118 -0.989 . . . . 0.0 111.35 169.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -68.22 -42.95 79.02 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.517 1.127 . . . . 0.0 112.643 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -67.03 -39.28 86.98 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.332 0.653 . . . . 0.0 112.141 177.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 54.5 t -62.44 -46.43 96.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 123.873 0.869 . . . . 0.0 110.838 170.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.78 -37.52 86.55 Favored 'General case' 0 N--CA 1.458 -0.071 0 C-N-CA 126.243 1.817 . . . . 0.0 114.027 -175.178 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 84.4 t60 -51.62 -51.12 58.17 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 122.677 0.391 . . . . 0.0 111.498 172.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 54.5 m-85 -74.74 -33.2 62.31 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 114.522 1.304 . . . . 0.0 114.522 174.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.68 -42.79 77.33 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 120.703 1.592 . . . . 0.0 112.905 178.517 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.04 -44.0 98.38 Favored Glycine 0 CA--C 1.53 1.008 0 N-CA-C 111.548 -0.621 . . . . 0.0 111.548 173.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.7 tp60 -60.27 -42.05 94.59 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.449 1.099 . . . . 0.0 112.429 172.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 68.3 t80 -64.6 -51.66 61.57 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.837 1.255 . . . . 0.0 110.718 178.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 59.8 mt -62.09 -37.47 78.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 C-N-CA 123.855 0.862 . . . . 0.0 110.398 178.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -63.58 -47.3 82.07 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.492 1.117 . . . . 0.0 112.748 174.247 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.0 p -78.43 -28.06 14.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 124.111 0.965 . . . . 0.0 113.5 -174.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 20.9 mmtp -95.48 -12.03 26.53 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.317 1.447 . . . . 0.0 113.826 174.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 16.5 mp0 55.37 61.41 2.89 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.612 1.965 . . . . 0.0 113.632 -177.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 40.2 mt -92.77 4.53 53.63 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.543 0.737 . . . . 0.0 112.907 173.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 51.7 p90 -89.46 153.67 20.64 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.362 1.465 . . . . 0.0 110.531 169.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -79.69 122.29 26.37 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.732 -0.605 . . . . 0.0 109.381 169.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 4.6 pm0 -61.86 -34.83 76.7 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.732 1.012 . . . . 0.0 113.732 -174.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -82.86 -25.21 32.79 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.614 0.766 . . . . 0.0 111.799 -175.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -139.98 74.51 1.47 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.998 2.119 . . . . 0.0 110.682 -179.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -58.23 -14.93 8.19 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 114.697 1.369 . . . . 0.0 114.697 -178.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 21.7 p80 -67.8 -1.91 6.25 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 117.995 -1.002 . . . . 0.0 113.668 169.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 14.8 ttm -117.74 140.01 50.27 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.933 1.693 . . . . 0.0 113.284 169.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 54.8 t -115.71 142.42 28.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 127.572 2.349 . . . . 0.0 109.608 169.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -123.04 52.83 1.33 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.287 1.435 . . . . 0.0 112.135 -173.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 67.9 m -75.16 2.41 10.9 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 120.748 -1.22 . . . . 0.0 114.277 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.36 -23.64 54.06 Favored Glycine 0 CA--C 1.539 1.586 0 CA-C-N 120.155 1.343 . . . . 0.0 114.655 173.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -88.34 2.46 85.05 Favored Glycine 0 CA--C 1.54 1.651 0 C-N-CA 124.964 1.269 . . . . 0.0 115.34 171.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -111.56 -174.42 2.46 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 119.158 1.479 . . . . 0.0 113.217 -172.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -63.92 -33.9 76.74 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 120.873 -1.142 . . . . 0.0 111.759 176.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.5 tp -65.22 -38.61 90.96 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-O 121.821 0.819 . . . . 0.0 110.207 173.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -64.02 -40.63 98.37 Favored Glycine 0 CA--C 1.532 1.138 0 C-N-CA 125.074 1.321 . . . . 0.0 113.602 171.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -73.07 -29.42 62.95 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 120.248 2.024 . . . . 0.0 112.009 177.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 23.7 tp -65.57 -50.01 66.73 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.023 1.329 . . . . 0.0 111.65 172.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.45 -5.78 31.74 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 -173.604 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 77.74 -28.19 1.86 Allowed Glycine 0 CA--C 1.54 1.652 0 C-N-CA 125.502 1.525 . . . . 0.0 113.627 -170.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.3 128.83 9.22 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 127.925 2.49 . . . . 0.0 110.451 175.499 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -140.63 40.57 1.86 Allowed 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.608 1.163 . . . . 0.0 110.072 175.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 10.7 m -103.77 132.22 50.23 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 169.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 40.1 p90 -163.51 169.32 18.94 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.219 1.407 . . . . 0.0 112.384 -167.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 17.2 m -107.64 135.3 49.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 122.396 1.093 . . . . 0.0 110.95 173.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -78.16 -23.4 13.66 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 C-N-CA 125.839 1.656 . . . . 0.0 113.332 -169.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.7 pttt -79.97 -5.28 55.39 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 126.299 1.84 . . . . 0.0 115.333 179.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 42.8 t0 -116.21 86.32 17.17 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 126.373 1.869 . . . . 0.0 110.735 -170.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -61.1 -36.94 79.12 Favored 'Trans proline' 0 CA--C 1.537 0.674 0 C-N-CA 124.29 3.327 . . . . 0.0 115.423 -170.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 67.9 m -58.95 -54.91 51.72 Favored Pre-proline 0 N--CA 1.477 0.894 0 CA-C-N 119.848 1.204 . . . . 0.0 114.076 -175.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -70.05 -24.75 27.98 Favored 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 121.956 1.771 . . . . 0.0 112.97 175.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 24.0 tp -67.83 -48.94 64.81 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.323 1.049 . . . . 0.0 110.822 178.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 22.9 m-30 -62.5 -35.71 80.25 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.856 0.862 . . . . 0.0 112.572 177.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -59.88 -42.32 93.52 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.002 0.921 . . . . 0.0 112.735 178.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 35.4 mtm -72.01 -48.67 43.01 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.795 0.838 . . . . 0.0 112.521 172.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -59.13 -39.59 82.83 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-O 117.793 -1.099 . . . . 0.0 110.974 -175.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 76.6 mtt180 -54.71 -25.48 27.73 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 171.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -87.67 -24.1 24.01 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.437 1.495 . . . . 0.0 114.081 173.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -111.05 -28.38 8.34 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 114.112 1.152 . . . . 0.0 114.112 -170.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 3.2 tt -133.93 117.55 16.87 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 127.587 2.355 . . . . 0.0 108.021 -177.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 84.2 t -61.49 119.36 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 O-C-N 121.588 -0.695 . . . . 0.0 111.332 -171.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 5.2 t -158.35 179.73 8.87 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 126.551 1.94 . . . . 0.0 110.346 178.019 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -94.14 170.43 9.53 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.535 1.134 . . . . 0.0 113.723 -170.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -125.2 169.87 11.81 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.741 2.017 . . . . 0.0 113.175 -169.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 12.0 t . . . . . 0 N--CA 1.479 1.021 0 C-N-CA 124.155 0.982 . . . . 0.0 113.458 176.673 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 200' ' ' 44Z . . . . . 0.438 ' CD3' ' CG1' ' A' ' 200' ' ' 44Z . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 . . . . . 0 CA--C 1.543 0.691 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.3 mt -117.46 30.74 2.13 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.975 0 C-N-CA 126.688 1.995 . . . . 0.0 109.822 179.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 69.4 m-20 50.74 34.71 10.48 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 126.636 1.974 . . . . 0.0 113.673 -175.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.1 pm0 -84.56 173.55 10.71 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -171.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 35.7 m -131.37 172.36 16.39 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 127.054 2.141 . . . . 0.0 111.548 -176.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.8 ttp-105 -93.73 137.15 23.31 Favored Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 125.405 1.482 . . . . 0.0 111.438 178.113 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -75.81 177.98 8.01 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 124.36 3.374 . . . . 0.0 113.843 -178.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.9 ttmt -61.82 147.08 47.62 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.366 1.066 . . . . 0.0 110.549 175.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.3 mp -54.07 -48.09 95.16 Favored Pre-proline 0 N--CA 1.472 0.67 0 N-CA-C 115.016 1.487 . . . . 0.0 115.016 -168.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -60.56 -31.26 92.1 Favored 'Trans proline' 0 CA--C 1.537 0.642 0 CA-C-N 122.053 1.769 . . . . 0.0 113.796 177.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 7.5 tt -77.59 -34.7 53.49 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 120.941 -1.1 . . . . 0.0 111.381 177.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 45.1 tp -61.36 -38.53 87.28 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.697 -0.627 . . . . 0.0 111.005 169.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -66.57 -35.58 80.56 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.83 0.852 . . . . 0.0 113.042 174.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 93.5 mt -60.55 -45.48 97.08 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 CA-C-N 119.41 1.004 . . . . 0.0 111.061 169.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.1 mp -69.22 -30.79 69.03 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 121.047 -1.033 . . . . 0.0 112.864 177.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 30.1 m170 -67.39 -42.88 82.62 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.188 -0.945 . . . . 0.0 111.557 169.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.23 -25.33 68.02 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.18 0.992 . . . . 0.0 113.117 174.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.62 -9.17 53.06 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 171.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 78.65 19.99 72.27 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 125.144 1.354 . . . . 0.0 114.254 -177.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -108.23 7.62 27.47 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 116.048 1.87 . . . . 0.0 116.048 -169.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.446 ' HG2' ' H ' ' A' ' 44' ' ' GLY . 7.3 tt0 48.85 -159.43 0.05 Allowed 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 126.069 1.748 . . . . 0.0 111.211 -169.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.446 ' H ' ' HG2' ' A' ' 43' ' ' GLN . . . 165.36 134.66 1.7 Allowed Glycine 0 N--CA 1.469 0.84 0 O-C-N 120.49 -1.381 . . . . 0.0 115.369 169.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -138.67 -19.99 1.03 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.794 1.238 . . . . 0.0 114.143 174.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 3.8 mtm -174.5 131.41 0.36 Allowed 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 128.0 2.52 . . . . 0.0 109.899 -178.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -163.56 152.4 14.08 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 114.569 1.322 . . . . 0.0 114.569 173.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 67.4 p -82.26 174.68 10.94 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 128.153 2.581 . . . . 0.0 112.343 174.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -53.06 -50.37 45.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 CA-C-N 119.908 1.231 . . . . 0.0 109.9 169.046 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 59.1 tptt -55.43 -37.87 68.23 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 119.043 0.838 . . . . 0.0 112.675 -176.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -80.4 -38.85 29.48 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.524 1.13 . . . . 0.0 113.265 175.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 41.9 t -68.11 -50.41 58.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 O-C-N 121.303 -0.873 . . . . 0.0 111.357 -179.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.7 mmm -68.66 -23.91 64.47 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 119.344 0.975 . . . . 0.0 112.642 -173.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -58.9 -55.6 33.07 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.657 0.783 . . . . 0.0 111.303 169.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -74.46 -32.08 62.47 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 177.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.83 -38.57 76.59 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 120.881 -1.137 . . . . 0.0 111.12 174.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.85 -42.05 99.75 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 124.194 0.902 . . . . 0.0 112.41 171.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.8 tp60 -60.37 -43.63 96.37 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.226 1.011 . . . . 0.0 112.11 171.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 61.6 t80 -60.44 -52.49 64.99 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.838 0.855 . . . . 0.0 110.788 174.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 44.0 mt -60.17 -37.04 71.75 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 124.084 0.954 . . . . 0.0 111.071 179.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -64.33 -46.6 82.79 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.372 1.069 . . . . 0.0 112.401 174.17 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.5 p -78.51 -28.52 14.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 N-CA-C 113.66 0.985 . . . . 0.0 113.66 -176.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 57.3 mmtt -91.88 -15.83 27.56 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.148 1.379 . . . . 0.0 113.731 175.038 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 14.1 mp0 54.23 73.26 0.4 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.973 2.109 . . . . 0.0 113.227 -172.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.3 tp -94.62 18.56 11.27 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.892 1.277 . . . . 0.0 112.484 178.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 51.2 p90 -127.53 160.3 31.94 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.628 1.971 . . . . 0.0 111.348 -173.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -81.34 124.74 29.62 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 121.567 -0.708 . . . . 0.0 111.176 172.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.02 -20.19 56.55 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 174.074 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -80.7 -36.69 31.9 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.732 0.813 . . . . 0.0 111.433 -176.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -149.55 92.38 1.92 Allowed 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 127.439 2.296 . . . . 0.0 109.441 -176.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 27.5 mp0 -65.59 -12.41 52.88 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 -169.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 24.3 p80 -66.01 -23.26 66.53 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 170.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 1.9 tpt -81.69 118.84 23.15 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.818 1.647 . . . . 0.0 110.498 175.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 18.2 t -104.14 130.64 54.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 125.904 1.682 . . . . 0.0 108.286 171.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 79.5 t80 -132.45 112.6 12.28 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.227 1.011 . . . . 0.0 109.686 -177.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 23.0 p -76.67 -28.98 56.17 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 114.539 1.311 . . . . 0.0 114.539 -169.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 50.87 -123.84 18.28 Favored Glycine 0 CA--C 1.539 1.567 0 CA-C-N 119.161 0.891 . . . . 0.0 112.136 -173.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -87.77 12.46 63.56 Favored Glycine 0 CA--C 1.542 1.733 0 C-N-CA 125.433 1.492 . . . . 0.0 116.214 176.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -63.12 159.38 17.55 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 119.746 1.773 . . . . 0.0 113.31 -179.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.1 mp -49.17 -37.37 22.18 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.799 1.64 . . . . 0.0 113.465 171.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 89.5 mt -59.76 -44.83 93.67 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 118.911 0.778 . . . . 0.0 111.405 175.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -73.14 -36.73 56.1 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 124.248 0.928 . . . . 0.0 113.099 176.079 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.29 -28.36 66.21 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 119.782 1.791 . . . . 0.0 112.191 178.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 42.9 tp -80.07 -54.53 5.69 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 124.289 1.036 . . . . 0.0 112.71 172.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -88.98 -7.03 56.77 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 123.846 0.858 . . . . 0.0 113.267 -172.095 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.41 -28.61 3.01 Favored Glycine 0 CA--C 1.54 1.605 0 C-N-CA 125.568 1.556 . . . . 0.0 113.001 -169.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.92 139.06 6.09 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 127.67 2.388 . . . . 0.0 111.6 -179.335 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -147.19 54.91 1.09 Allowed 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.904 1.282 . . . . 0.0 109.96 168.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 6.8 m -104.79 130.74 52.83 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-O 121.168 0.509 . . . . 0.0 109.793 169.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 54.4 p90 -168.22 177.04 5.65 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.786 1.634 . . . . 0.0 111.458 -168.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 67.2 p -121.55 143.24 49.4 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 174.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 20.5 m -71.28 -15.18 18.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 N-CA-C 113.996 1.11 . . . . 0.0 113.996 -173.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.0 pttt -77.59 -8.12 57.37 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 126.335 1.854 . . . . 0.0 114.419 172.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 44.6 t0 -119.6 78.17 21.0 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 126.142 1.777 . . . . 0.0 110.516 -177.199 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -68.56 -27.61 32.68 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 123.756 2.971 . . . . 0.0 115.288 -169.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 63.7 m -59.35 -54.39 56.62 Favored Pre-proline 0 N--CA 1.478 0.933 0 CA-C-N 120.341 1.428 . . . . 0.0 113.753 -177.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -66.46 -28.9 45.61 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 121.797 1.664 . . . . 0.0 112.585 173.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.97 -52.88 63.84 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.793 1.237 . . . . 0.0 110.631 176.006 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -66.48 -29.28 69.36 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.94 0.896 . . . . 0.0 113.379 174.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -61.76 -50.38 72.61 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.699 1.591 . . . . 0.0 112.377 174.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 36.4 mtm -65.53 -43.08 91.1 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.026 0.53 . . . . 0.0 111.595 175.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 42.8 mt -66.04 -42.27 89.8 Favored 'General case' 0 C--O 1.218 -0.578 0 CA-C-O 117.174 -1.393 . . . . 0.0 112.052 -179.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -56.02 -29.03 59.78 Favored 'General case' 0 N--CA 1.484 1.255 0 CA-C-N 121.347 1.885 . . . . 0.0 113.613 173.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -82.71 -17.6 43.85 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.518 1.527 . . . . 0.0 113.424 175.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -120.87 -15.0 8.41 Favored 'General case' 0 CA--C 1.556 1.196 0 N-CA-C 115.292 1.59 . . . . 0.0 115.292 -172.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 29.6 tp -150.38 139.93 21.55 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 130.484 3.514 . . . . 0.0 108.598 -171.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 48.7 t -75.47 109.99 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 O-C-N 120.795 -1.191 . . . . 0.0 109.387 174.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 7.7 t -155.27 170.16 22.52 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.18 1.392 . . . . 0.0 111.841 -177.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -79.46 177.3 8.96 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.288 1.435 . . . . 0.0 114.124 -178.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -126.86 -176.95 3.85 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.696 1.598 . . . . 0.0 113.818 -169.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 6.0 t . . . . . 0 N--CA 1.475 0.815 0 C-N-CA 125.946 1.698 . . . . 0.0 112.747 -170.554 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 200' ' ' 44Z . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 . . . . . 0 CA--C 1.539 0.547 0 CA-C-O 121.896 0.855 . . . . 0.0 112.25 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 23.2 pt -87.45 -16.25 9.22 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.11 0 N-CA-C 116.989 2.218 . . . . 0.0 116.989 -169.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 54.6 t30 53.18 34.49 17.62 Favored 'General case' 0 CA--C 1.557 1.214 0 C-N-CA 126.185 1.794 . . . . 0.0 113.858 -174.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 27.9 mm100 -94.77 167.03 11.69 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.507 1.923 . . . . 0.0 112.218 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 35.5 m -104.17 159.89 4.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 125.323 1.449 . . . . 0.0 113.257 -169.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 84.1 mtm-85 -91.75 138.63 24.92 Favored Pre-proline 0 N--CA 1.479 0.992 0 C-N-CA 124.432 1.093 . . . . 0.0 111.167 176.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -80.92 171.88 13.73 Favored 'Trans proline' 0 CA--C 1.538 0.679 0 C-N-CA 123.986 3.124 . . . . 0.0 113.038 178.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.03 149.43 15.51 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.664 0.786 . . . . 0.0 112.475 173.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 92.5 mt -59.85 -50.03 88.6 Favored Pre-proline 0 N--CA 1.476 0.875 0 N-CA-C 114.099 1.148 . . . . 0.0 114.099 -175.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -67.33 -21.34 47.65 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 121.897 1.731 . . . . 0.0 113.118 174.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.4 tt -69.66 -46.03 67.04 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 118.944 0.793 . . . . 0.0 109.826 170.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.2 tp -60.31 -31.76 70.58 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 120.865 -1.147 . . . . 0.0 112.955 176.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.62 -28.85 68.84 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 121.493 -0.754 . . . . 0.0 112.678 171.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 45.0 mt -71.03 -43.89 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 CA-C-N 119.073 0.851 . . . . 0.0 110.573 173.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.88 -38.94 87.4 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.485 0.714 . . . . 0.0 110.733 175.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 53.3 m170 -66.46 -43.83 84.44 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.426 0.69 . . . . 0.0 112.457 172.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.43 -27.99 69.67 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.945 0.898 . . . . 0.0 113.376 176.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.74 -5.22 36.29 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 124.222 1.009 . . . . 0.0 113.475 172.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.54 9.04 65.18 Favored Glycine 0 CA--C 1.537 1.456 0 C-N-CA 125.422 1.487 . . . . 0.0 115.102 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -97.96 165.67 11.81 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.752 1.221 . . . . 0.0 112.952 179.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 21.7 tm0? -118.03 145.22 44.94 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.65 1.58 . . . . 0.0 109.335 169.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -171.77 158.46 29.34 Favored Glycine 0 N--CA 1.467 0.724 0 N-CA-C 116.287 1.275 . . . . 0.0 116.287 -169.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -140.44 -63.69 0.48 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.987 1.715 . . . . 0.0 109.643 169.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 3.3 mpp? -101.63 141.7 34.1 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 127.14 2.176 . . . . 0.0 112.183 179.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 25.0 m-85 -154.41 159.78 41.28 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.369 1.067 . . . . 0.0 113.678 -175.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 71.3 p -95.21 175.02 6.77 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.353 1.461 . . . . 0.0 108.052 166.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -59.08 -40.18 80.24 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 O-C-N 120.011 -1.681 . . . . 0.0 109.981 169.148 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -59.8 -43.99 94.18 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.768 1.227 . . . . 0.0 112.756 178.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -72.67 -36.74 67.99 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 178.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 75.3 t -65.73 -51.95 56.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 CA-C-N 119.388 0.995 . . . . 0.0 110.669 171.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.4 ppp? -68.88 -26.06 64.93 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -169.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 82.8 t60 -60.18 -53.49 57.09 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 119.101 0.864 . . . . 0.0 111.27 172.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 57.3 m-85 -74.4 -30.38 61.92 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 178.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -68.64 -39.76 80.57 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.326 0.966 . . . . 0.0 112.735 172.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.52 -43.58 97.9 Favored Glycine 0 CA--C 1.532 1.132 0 CA-C-N 118.761 0.71 . . . . 0.0 111.722 172.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 36.1 tp60 -58.67 -45.35 89.61 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.104 0.961 . . . . 0.0 112.156 170.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 51.7 t80 -60.62 -51.59 68.75 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.708 0.803 . . . . 0.0 110.433 177.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 48.7 mt -59.19 -38.87 76.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 124.368 1.067 . . . . 0.0 111.039 178.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.0 tpt -64.57 -45.3 87.62 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.387 1.075 . . . . 0.0 112.726 175.05 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.1 p -78.67 -29.54 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-N 119.703 1.138 . . . . 0.0 113.716 -177.024 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 58.0 mmtt -90.74 -15.91 29.38 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.806 1.242 . . . . 0.0 113.36 175.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 14.1 mp0 50.89 73.73 0.27 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 127.182 2.193 . . . . 0.0 112.856 -172.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 11.8 tp -87.44 -4.45 59.01 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.855 0.862 . . . . 0.0 112.187 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 51.3 p90 -99.18 160.0 14.58 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.53 1.932 . . . . 0.0 111.784 177.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -91.99 134.28 34.95 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 169.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -59.6 -32.21 70.18 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -174.471 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -86.62 -20.49 27.78 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 123.795 0.838 . . . . 0.0 112.578 -169.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -140.37 63.28 1.47 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 127.985 2.514 . . . . 0.0 110.257 -178.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -60.22 -19.77 55.89 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.966 0.906 . . . . 0.0 113.254 -179.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 31.8 p80 -63.09 -7.32 5.35 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.43 1.092 . . . . 0.0 113.889 170.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 39.4 mtp -121.0 149.25 42.95 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.35 1.46 . . . . 0.0 112.926 169.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.9 p -124.1 144.37 34.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 126.075 1.75 . . . . 0.0 109.62 173.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -128.73 110.13 11.92 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.792 1.237 . . . . 0.0 110.586 -170.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 19.8 p -78.61 17.09 0.73 Allowed 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 116.723 2.12 . . . . 0.0 116.723 -168.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -53.57 113.14 2.83 Favored Glycine 0 CA--C 1.537 1.438 0 CA-C-N 119.577 1.08 . . . . 0.0 113.605 -172.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 73.6 9.34 78.28 Favored Glycine 0 CA--C 1.541 1.665 0 C-N-CA 124.979 1.276 . . . . 0.0 115.791 -177.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -86.88 158.67 19.28 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 119.355 1.577 . . . . 0.0 113.531 -175.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 27.9 mt -54.31 -37.22 64.59 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.926 1.29 . . . . 0.0 113.126 169.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.61 -42.34 96.63 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.373 -0.829 . . . . 0.0 111.347 174.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -70.49 -34.01 67.89 Favored Glycine 0 CA--C 1.532 1.109 0 CA-C-O 118.609 -1.106 . . . . 0.0 112.986 175.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -71.62 -29.24 64.45 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 120.218 2.009 . . . . 0.0 111.79 175.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 27.7 tp -71.32 -53.09 15.4 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 124.777 1.231 . . . . 0.0 112.419 174.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -102.49 -9.74 19.97 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.085 1.143 . . . . 0.0 114.085 -169.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.03 -32.89 1.97 Allowed Glycine 0 CA--C 1.54 1.625 0 C-N-CA 124.896 1.236 . . . . 0.0 112.57 -169.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.45 123.19 8.62 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 126.777 2.031 . . . . 0.0 112.553 174.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 -136.86 33.8 2.65 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.595 1.558 . . . . 0.0 111.172 177.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 11.4 m -94.14 132.37 38.74 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 169.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 49.6 p90 -162.35 172.33 15.8 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.335 1.054 . . . . 0.0 112.961 -169.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 81.6 p -116.19 136.42 53.03 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 122.452 1.12 . . . . 0.0 113.586 175.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -78.05 -17.69 13.86 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.442 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 -174.668 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.5 pttt -72.8 -8.47 55.63 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.666 1.586 . . . . 0.0 114.637 175.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -120.57 83.36 34.58 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 126.386 1.875 . . . . 0.0 110.147 -177.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -68.12 -25.2 37.74 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.862 3.041 . . . . 0.0 115.224 -169.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 62.5 m -63.52 -54.89 39.55 Favored Pre-proline 0 N--CA 1.476 0.875 0 CA-C-N 119.813 1.188 . . . . 0.0 113.87 -178.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -65.5 -30.38 52.37 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 121.827 1.685 . . . . 0.0 112.553 175.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 22.4 tp -62.61 -47.95 81.54 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.983 0.913 . . . . 0.0 111.11 174.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -59.99 -37.98 81.27 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 121.489 -0.757 . . . . 0.0 112.179 173.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -64.28 -47.26 80.22 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.043 0.937 . . . . 0.0 112.939 176.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 3.9 mtp -56.9 -44.46 82.38 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.335 1.054 . . . . 0.0 112.111 172.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.1 mp -62.53 -47.17 85.06 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.392 1.077 . . . . 0.0 110.567 176.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 14.8 mtt180 -56.98 -21.64 31.96 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.68 1.192 . . . . 0.0 114.142 171.011 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -98.57 -5.17 32.54 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 126.396 1.878 . . . . 0.0 115.01 175.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 18.9 p30 -115.88 -27.6 6.95 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 120.349 1.432 . . . . 0.0 114.479 175.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 39.8 tp -91.27 99.32 12.32 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 126.565 1.946 . . . . 0.0 111.905 175.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . 0.324 0.4 OUTLIER 58.47 1.94 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 N-CA-C 120.127 3.38 . . . . 0.0 120.127 169.726 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 3.0 t -165.5 -179.83 5.69 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 124.416 1.086 . . . . 0.0 112.921 -177.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -118.43 71.45 0.84 Allowed 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 127.185 2.194 . . . . 0.0 111.245 173.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . 56.23 -174.49 0.06 Allowed 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 126.339 1.856 . . . . 0.0 115.088 -178.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 11.8 t . . . . . 0 N--CA 1.48 1.045 0 C-N-CA 124.216 1.006 . . . . 0.0 113.293 -179.738 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 200' ' ' 44Z . . . . . 0.476 ' CD3' ' CD1' ' A' ' 200' ' ' 44Z . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 26.2 mp0 . . . . . 0 CA--C 1.542 0.668 0 CA-C-O 121.174 0.512 . . . . 0.0 112.322 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 15.0 mt -132.1 150.78 34.01 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 125.884 1.674 . . . . 0.0 109.479 -178.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 48.4 p-10 -100.22 32.83 2.84 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 126.304 1.841 . . . . 0.0 113.617 178.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 5.1 pm0 -80.18 169.51 17.7 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.16 1.384 . . . . 0.0 113.453 -176.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 33.5 m -127.77 172.24 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 126.124 1.77 . . . . 0.0 111.706 -177.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.7 ttp-105 -87.11 133.04 39.83 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 124.693 1.197 . . . . 0.0 111.721 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -73.19 175.8 10.04 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 123.586 2.857 . . . . 0.0 112.228 173.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.5 tpmt? -61.52 147.31 45.82 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.472 0.709 . . . . 0.0 110.605 177.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -59.32 -40.63 82.05 Favored Pre-proline 0 N--CA 1.473 0.714 0 CA-C-O 117.32 -1.324 . . . . 0.0 114.239 -170.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -61.06 -33.85 91.06 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 121.994 1.796 . . . . 0.0 113.696 173.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.2 tt -70.12 -40.75 74.7 Favored 'General case' 0 CA--C 1.546 0.804 0 O-C-N 121.469 -0.769 . . . . 0.0 109.666 175.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.8 tt -63.91 -35.4 80.54 Favored 'General case' 0 N--CA 1.475 0.825 0 O-C-N 120.858 -1.151 . . . . 0.0 112.791 172.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.66 -38.91 92.15 Favored 'General case' 0 N--CA 1.48 1.026 0 O-C-N 121.216 -0.928 . . . . 0.0 112.223 170.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 91.8 mt -67.06 -38.33 81.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 123.676 0.79 . . . . 0.0 111.636 174.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 77.0 mt -61.99 -40.73 96.63 Favored 'General case' 0 CA--C 1.544 0.75 0 O-C-N 121.107 -0.996 . . . . 0.0 112.142 170.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 34.8 m170 -62.22 -42.95 99.77 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 119.332 0.969 . . . . 0.0 112.293 170.03 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.25 -25.43 68.05 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 177.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.91 -7.37 50.66 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 172.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 89.4 6.35 71.02 Favored Glycine 0 CA--C 1.537 1.449 0 C-N-CA 125.228 1.394 . . . . 0.0 114.584 -175.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -87.71 177.86 6.91 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.706 1.202 . . . . 0.0 112.263 175.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.96 149.3 43.12 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.257 1.423 . . . . 0.0 109.942 172.339 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 176.12 161.68 25.68 Favored Glycine 0 CA--C 1.527 0.802 0 N-CA-C 116.791 1.476 . . . . 0.0 116.791 170.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -125.65 8.52 7.62 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 126.018 1.727 . . . . 0.0 112.444 171.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.1 mtm -170.95 135.36 1.03 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 128.888 2.875 . . . . 0.0 109.055 -177.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -149.27 144.39 26.47 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -176.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 46.6 p -86.59 169.47 12.73 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.471 1.108 . . . . 0.0 111.304 168.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.1 t -56.16 -46.18 81.06 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 O-C-N 120.661 -1.274 . . . . 0.0 109.943 169.338 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -56.59 -35.93 68.8 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.721 0.808 . . . . 0.0 113.074 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -77.32 -46.16 23.82 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 173.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 74.8 t -63.93 -49.45 81.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 O-C-N 121.451 -0.781 . . . . 0.0 111.756 -177.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -71.24 -27.28 63.36 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 119.89 1.223 . . . . 0.0 112.287 -172.261 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -58.81 -54.45 46.95 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.345 0.658 . . . . 0.0 111.118 170.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -74.35 -32.29 62.73 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 178.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -68.05 -41.98 81.19 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 119.996 1.271 . . . . 0.0 111.823 173.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -61.36 -47.28 91.67 Favored Glycine 0 CA--C 1.527 0.81 0 CA-C-N 119.018 0.826 . . . . 0.0 111.624 173.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.3 tp60 -55.97 -47.9 76.8 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.384 1.073 . . . . 0.0 112.094 172.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -60.36 -48.79 80.25 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.121 0.968 . . . . 0.0 110.894 177.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 58.3 mt -60.85 -36.93 74.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 125.21 1.404 . . . . 0.0 111.148 178.244 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 35.3 mmt -66.34 -38.52 87.83 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.551 1.068 . . . . 0.0 113.051 171.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 82.2 t -78.31 -32.21 16.66 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 CA-C-N 119.217 0.917 . . . . 0.0 112.906 -178.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 47.2 mmtt -91.47 -15.54 28.67 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.159 1.383 . . . . 0.0 113.0 177.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.5 mp0 52.3 63.98 2.03 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.344 1.857 . . . . 0.0 113.038 -173.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 89.5 mt -92.46 18.95 7.74 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 124.432 1.093 . . . . 0.0 112.146 176.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 36.0 p90 -124.33 158.49 32.49 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 126.517 1.927 . . . . 0.0 111.005 -177.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -87.08 128.43 35.1 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.791 -0.568 . . . . 0.0 111.175 172.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -61.51 -20.72 63.52 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 172.059 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -81.78 -36.56 28.32 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.055 0.942 . . . . 0.0 111.291 -177.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -148.24 85.02 1.51 Allowed 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 127.321 2.248 . . . . 0.0 109.867 -173.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 28.3 mp0 -62.5 -15.64 51.28 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -172.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 27.3 p80 -65.88 -23.74 66.71 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 172.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.2 tpt -81.77 128.66 34.23 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.536 1.534 . . . . 0.0 110.758 175.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 3.9 t -126.16 112.39 29.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 C-N-CA 125.48 1.512 . . . . 0.0 109.4 179.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 35.9 t80 -95.46 52.25 1.37 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.875 1.27 . . . . 0.0 112.09 -170.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 55.6 m -69.69 -5.39 24.65 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 179.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.63 -25.12 58.04 Favored Glycine 0 CA--C 1.541 1.704 0 CA-C-N 120.116 1.326 . . . . 0.0 113.524 169.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -88.81 2.83 84.66 Favored Glycine 0 CA--C 1.542 1.728 0 C-N-CA 125.392 1.472 . . . . 0.0 115.295 171.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -108.93 172.99 6.52 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.174 1.79 . . . . 0.0 112.552 -177.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.8 tp -46.57 -43.05 16.84 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 126.809 2.044 . . . . 0.0 112.11 169.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 67.4 mt -54.79 -43.14 72.6 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-O 122.113 0.959 . . . . 0.0 112.159 173.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -74.64 -32.24 57.63 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 125.95 1.738 . . . . 0.0 114.412 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -67.25 -42.66 83.57 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 120.109 1.955 . . . . 0.0 110.374 169.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 24.9 tp -59.64 -50.95 71.88 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.413 1.485 . . . . 0.0 111.903 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -96.58 -13.8 22.67 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 -178.591 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.77 -18.24 12.85 Favored Glycine 0 CA--C 1.541 1.688 0 C-N-CA 125.641 1.591 . . . . 0.0 115.825 -178.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.41 17.99 1.52 Allowed 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 115.934 1.827 . . . . 0.0 115.934 -176.697 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.7 tp60 -68.05 40.73 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.045 0 N-CA-C 118.011 2.597 . . . . 0.0 118.011 -167.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 72.4 m -97.71 144.01 27.78 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 120.419 -1.426 . . . . 0.0 109.202 168.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . 0.422 ' CD1' ' HE1' ' A' ' 101' ' ' MET . 55.0 p90 -159.5 162.98 35.62 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -169.016 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 13.8 m -125.43 136.55 53.51 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.394 1.078 . . . . 0.0 110.679 177.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 20.1 m -77.42 -11.38 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -170.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -78.04 -13.88 59.71 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.875 1.27 . . . . 0.0 113.498 178.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -120.56 81.22 31.64 Favored Pre-proline 0 CA--C 1.547 0.86 0 C-N-CA 127.916 2.486 . . . . 0.0 108.874 179.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.18 -27.51 16.67 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 123.502 2.801 . . . . 0.0 114.739 -169.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 45.6 m -57.28 -51.06 84.54 Favored Pre-proline 0 N--CA 1.478 0.938 0 CA-C-N 120.342 1.428 . . . . 0.0 114.21 -178.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -67.49 -27.45 39.5 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 121.901 1.734 . . . . 0.0 113.38 175.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 21.8 tp -68.81 -42.45 77.26 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.292 1.037 . . . . 0.0 110.957 174.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -61.55 -33.79 74.45 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 118.126 -0.94 . . . . 0.0 112.675 172.395 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -62.96 -47.07 84.77 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 120.408 1.458 . . . . 0.0 112.377 176.384 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.422 ' HE1' ' CD1' ' A' ' 90' ' ' PHE . 5.7 mtm -58.78 -47.43 84.75 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.023 0.929 . . . . 0.0 111.631 172.488 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.8 mp -67.06 -38.75 86.36 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 118.033 -0.984 . . . . 0.0 112.305 -179.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 7.6 mpt_? -56.04 -24.99 42.98 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-N 120.539 1.518 . . . . 0.0 113.345 171.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -93.07 -13.62 28.35 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.057 1.743 . . . . 0.0 114.076 176.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 21.6 t30 -131.89 -20.06 2.54 Favored 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 116.579 2.066 . . . . 0.0 116.579 -173.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 48.3 tp -133.39 124.05 26.45 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 126.498 1.919 . . . . 0.0 114.693 -169.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . 0.321 0.9 OUTLIER 49.63 13.83 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 C-N-CA 129.607 3.163 . . . . 0.0 119.098 168.173 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 4.9 t -166.21 178.13 6.47 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.005 1.722 . . . . 0.0 111.189 176.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -112.3 -20.32 11.89 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 115.441 1.645 . . . . 0.0 115.441 176.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -174.83 162.99 3.3 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 128.175 2.59 . . . . 0.0 112.465 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 68.7 p . . . . . 0 N--CA 1.486 1.366 0 C-N-CA 127.005 2.122 . . . . 0.0 115.124 169.434 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 200' ' ' 44Z . . . . . 0.412 ' H32' ' C6 ' ' A' ' 200' ' ' 44Z . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 . . . . . 0 CA--C 1.544 0.722 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -106.43 17.63 6.1 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.0 0 C-N-CA 126.127 1.771 . . . . 0.0 111.793 -170.338 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 53.7 t30 50.56 38.36 18.52 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 125.927 1.691 . . . . 0.0 112.94 -173.357 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 10.1 pm0 -80.78 173.37 12.67 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.728 1.611 . . . . 0.0 113.496 -171.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 18.9 m -116.95 167.37 10.12 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 126.033 1.733 . . . . 0.0 112.925 -170.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.3 ttp180 -90.76 130.21 41.73 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 124.876 1.27 . . . . 0.0 112.258 -174.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -70.38 176.51 7.14 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 124.09 3.194 . . . . 0.0 112.872 169.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -58.8 144.17 44.93 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.871 0.868 . . . . 0.0 109.786 173.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 86.1 mt -63.43 -38.6 41.2 Favored Pre-proline 0 N--CA 1.476 0.856 0 N-CA-C 114.697 1.369 . . . . 0.0 114.697 -169.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -62.98 -33.34 74.75 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 121.686 1.591 . . . . 0.0 113.217 170.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 8.8 tt -68.97 -45.19 71.29 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.387 0.994 . . . . 0.0 111.048 176.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.4 tt -52.33 -38.99 60.07 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.97 0.908 . . . . 0.0 111.333 169.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.59 -28.06 68.86 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.893 1.071 . . . . 0.0 113.893 176.44 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 65.2 mt -68.63 -40.41 81.73 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 CA-C-N 119.362 0.983 . . . . 0.0 110.648 171.122 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.7 mp -64.96 -37.6 88.17 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.144 -0.972 . . . . 0.0 111.005 173.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 17.9 m170 -64.09 -40.01 95.3 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.63 -0.669 . . . . 0.0 111.771 172.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.87 -29.34 70.54 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.991 0.917 . . . . 0.0 113.01 173.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.28 -2.49 22.19 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.227 1.011 . . . . 0.0 113.488 171.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.93 7.31 64.47 Favored Glycine 0 CA--C 1.536 1.361 0 C-N-CA 125.729 1.633 . . . . 0.0 114.978 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -106.56 109.45 21.37 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 118.777 1.289 . . . . 0.0 112.282 -175.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.8 tm0? -69.84 141.82 53.18 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.22 0.608 . . . . 0.0 110.149 170.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 172.01 168.17 33.13 Favored Glycine 0 N--CA 1.466 0.695 0 C-N-CA 123.595 0.617 . . . . 0.0 114.478 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -128.08 -57.91 1.23 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.389 1.476 . . . . 0.0 111.293 179.18 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 24.0 mtm -106.06 125.71 51.32 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.846 1.658 . . . . 0.0 111.876 -177.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -139.21 145.23 39.02 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.256 1.022 . . . . 0.0 113.417 -173.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 52.9 p -88.38 174.66 8.02 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 125.482 1.513 . . . . 0.0 111.848 169.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 2.6 t -56.25 -46.03 81.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 120.441 -1.412 . . . . 0.0 109.837 168.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 63.4 tttm -58.75 -40.49 84.0 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.871 0.868 . . . . 0.0 112.423 -179.154 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -74.98 -36.41 62.02 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 175.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 67.6 t -67.36 -58.35 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 CA-C-O 117.78 -1.105 . . . . 0.0 110.998 176.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.409 ' SD ' ' CD2' ' A' ' 200' ' ' 44Z . 16.1 mmt -60.59 -30.53 69.87 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-N 120.744 1.611 . . . . 0.0 112.889 -173.475 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -54.49 -59.09 5.15 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.704 173.323 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -74.72 -32.85 62.25 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 175.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.85 -40.67 60.87 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 120.801 -1.187 . . . . 0.0 112.043 -177.328 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.48 -40.69 99.05 Favored Glycine 0 CA--C 1.529 0.913 0 N-CA-C 111.604 -0.598 . . . . 0.0 111.604 171.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.8 tp60 -60.65 -45.01 95.71 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.13 0.972 . . . . 0.0 112.07 171.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 46.4 t80 -60.42 -51.6 68.81 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.347 1.059 . . . . 0.0 110.488 176.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 45.8 mt -61.58 -37.58 78.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 C-N-CA 124.024 0.929 . . . . 0.0 110.626 179.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -67.5 -42.28 83.1 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 119.425 1.011 . . . . 0.0 113.292 175.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.8 p -78.54 -30.08 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -177.218 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 21.9 mmtp -97.2 -12.4 23.07 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 125.112 1.365 . . . . 0.0 113.889 177.067 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.0 mp0 51.82 78.4 0.12 Allowed 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 126.95 2.1 . . . . 0.0 114.343 -176.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.6 tp -95.11 2.12 55.07 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.403 1.081 . . . . 0.0 112.884 177.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -102.04 162.17 13.12 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 127.627 2.371 . . . . 0.0 110.981 174.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -92.34 132.63 36.57 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 168.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.98 -29.02 64.91 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.165 0.893 . . . . 0.0 113.101 -176.627 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -78.34 -25.59 46.46 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.466 1.106 . . . . 0.0 111.862 -174.567 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -143.96 63.7 1.33 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 127.411 2.284 . . . . 0.0 110.127 -169.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -60.55 -20.0 59.03 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.823 0.849 . . . . 0.0 113.178 179.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 6.1 p-80 -66.28 -7.4 18.41 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.195 1.398 . . . . 0.0 113.867 169.411 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.6 ttm -124.95 143.48 50.86 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.438 1.895 . . . . 0.0 111.846 174.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.0 t -129.17 141.31 46.93 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 126.535 1.934 . . . . 0.0 108.878 -174.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -122.85 71.34 1.04 Allowed 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.582 1.153 . . . . 0.0 111.394 -171.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 3.5 m -87.71 8.1 27.08 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.185 1.18 . . . . 0.0 114.185 -173.092 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.42 -27.38 63.22 Favored Glycine 0 CA--C 1.54 1.6 0 O-C-N 120.852 -1.155 . . . . 0.0 114.64 179.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -89.43 3.89 83.91 Favored Glycine 0 CA--C 1.54 1.617 0 C-N-CA 125.186 1.374 . . . . 0.0 115.172 172.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -109.28 173.22 6.42 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.97 1.708 . . . . 0.0 112.508 -175.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.1 mp -53.17 -32.93 50.37 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.765 1.626 . . . . 0.0 113.041 169.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 95.8 mt -61.08 -47.51 85.99 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.102 -0.999 . . . . 0.0 111.397 170.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -63.61 -38.28 96.02 Favored Glycine 0 CA--C 1.531 1.053 0 CA-C-O 119.064 -0.853 . . . . 0.0 113.031 173.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.16 -29.24 62.71 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 119.903 1.851 . . . . 0.0 112.951 179.676 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.4 pp -80.66 -35.19 34.17 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 175.185 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.08 -7.49 23.16 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 119.266 0.939 . . . . 0.0 113.517 -177.817 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.08 -27.04 3.16 Favored Glycine 0 CA--C 1.541 1.659 0 O-C-N 120.164 -1.585 . . . . 0.0 113.35 -169.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.27 137.47 7.12 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 128.092 2.557 . . . . 0.0 110.789 177.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -144.75 56.36 1.27 Allowed 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 119.003 0.82 . . . . 0.0 110.608 169.331 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 6.7 m -102.78 129.24 49.37 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 168.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . 0.41 ' CD2' ' HE2' ' A' ' 101' ' ' MET . 52.3 p90 -163.4 173.8 12.75 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.693 1.197 . . . . 0.0 112.857 -168.057 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 52.9 p -119.97 146.14 46.11 Favored 'General case' 0 C--N 1.333 -0.139 0 C-N-CA 123.87 0.868 . . . . 0.0 112.984 172.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 14.4 m -77.68 -14.02 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 C-N-CA 123.157 0.583 . . . . 0.0 112.435 169.562 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 22.6 ttpp -64.73 -28.61 69.7 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.357 1.863 . . . . 0.0 112.598 169.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -117.55 77.47 10.72 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 126.46 1.904 . . . . 0.0 110.003 177.044 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -69.78 -24.78 29.18 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 123.613 2.875 . . . . 0.0 115.023 -169.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 48.8 m -60.4 -52.75 70.73 Favored Pre-proline 0 N--CA 1.477 0.886 0 CA-C-N 120.11 1.323 . . . . 0.0 114.124 -177.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -64.54 -32.33 59.18 Favored 'Trans proline' 0 CA--C 1.539 0.765 0 C-N-CA 122.109 1.872 . . . . 0.0 113.081 175.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 19.6 tp -65.38 -43.39 90.86 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 121.247 -0.908 . . . . 0.0 111.046 173.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -63.85 -37.4 87.26 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.745 0.818 . . . . 0.0 112.223 174.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -62.71 -47.51 83.28 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.836 0.854 . . . . 0.0 112.655 174.419 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.41 ' HE2' ' CD2' ' A' ' 90' ' ' PHE . 32.0 mtm -58.99 -46.72 87.44 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.211 0.604 . . . . 0.0 112.223 171.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 59.0 mt -58.55 -47.18 85.07 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.064 0.946 . . . . 0.0 111.821 177.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 34.9 mtp180 -54.46 -25.11 23.22 Favored 'General case' 0 N--CA 1.482 1.168 0 CA-C-N 119.768 1.167 . . . . 0.0 113.535 173.059 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -91.55 -15.41 28.74 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 126.259 1.823 . . . . 0.0 114.655 176.331 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 14.6 p30 -116.29 -23.14 8.5 Favored 'General case' 0 N--CA 1.483 1.225 0 CA-C-N 120.485 1.493 . . . . 0.0 114.587 179.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 30.0 tp -113.26 95.84 5.59 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 128.405 2.682 . . . . 0.0 106.101 169.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 45.2 t -61.63 129.67 24.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.588 0.755 . . . . 0.0 110.477 -169.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 2.7 t -155.72 -164.01 1.63 Allowed 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.962 1.305 . . . . 0.0 110.765 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 7.5 mp -65.69 -160.43 0.02 OUTLIER 'General case' 0 CA--C 1.557 1.217 0 C-N-CA 127.401 2.28 . . . . 0.0 109.108 167.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . 62.35 18.29 10.14 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 116.469 2.025 . . . . 0.0 116.469 169.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 3.8 t . . . . . 0 N--CA 1.478 0.939 0 C-N-CA 125.677 1.591 . . . . 0.0 111.938 174.93 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 200' ' ' 44Z . . . . . 0.409 ' CD2' ' SD ' ' A' ' 53' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 50.6 mm-40 . . . . . 0 CA--C 1.541 0.625 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.8 pp -82.59 162.54 3.27 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 C-N-CA 125.852 1.661 . . . . 0.0 112.495 174.434 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 28.4 m120 -101.78 3.04 39.05 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.678 1.191 . . . . 0.0 113.616 -178.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.81 168.28 18.17 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.634 1.574 . . . . 0.0 113.044 -172.361 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 31.7 m -104.23 172.79 1.46 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 C-N-CA 128.161 2.585 . . . . 0.0 112.07 -174.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 95.4 mtm-85 -86.18 149.42 49.88 Favored Pre-proline 0 N--CA 1.48 1.037 0 O-C-N 121.004 -1.06 . . . . 0.0 111.217 -177.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -73.19 174.65 11.71 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 123.155 2.57 . . . . 0.0 111.823 169.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt -62.94 148.46 47.4 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.406 1.082 . . . . 0.0 110.054 177.112 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 94.0 mt -55.74 -46.73 99.7 Favored Pre-proline 0 N--CA 1.476 0.832 0 N-CA-C 115.24 1.57 . . . . 0.0 115.24 -168.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -66.4 -23.54 50.95 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 CA-C-N 122.509 1.932 . . . . 0.0 114.247 175.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.3 tt -71.78 -39.97 69.57 Favored 'General case' 0 N--CA 1.474 0.725 0 O-C-N 120.85 -1.156 . . . . 0.0 109.932 170.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 13.6 tp -61.58 -34.58 75.86 Favored 'General case' 0 CA--C 1.548 0.895 0 O-C-N 121.12 -0.987 . . . . 0.0 111.665 170.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.405 ' HA ' ' HE2' ' A' ' 35' ' ' LYS . 8.5 mmpt? -65.43 -39.34 91.97 Favored 'General case' 0 N--CA 1.481 1.095 0 O-C-N 121.147 -0.971 . . . . 0.0 112.649 170.012 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 52.6 mt -63.57 -38.88 83.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 124.401 1.08 . . . . 0.0 111.844 172.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.9 mt -61.52 -41.04 96.72 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 121.058 -1.026 . . . . 0.0 112.235 169.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 49.4 m170 -64.68 -41.93 95.7 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 121.494 -0.754 . . . . 0.0 112.209 172.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.91 -25.0 67.7 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.774 1.23 . . . . 0.0 113.331 177.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.44 -6.5 40.84 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.904 0.881 . . . . 0.0 113.313 171.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.03 12.73 59.9 Favored Glycine 0 CA--C 1.536 1.388 0 C-N-CA 125.177 1.37 . . . . 0.0 114.453 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -108.92 163.16 13.53 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.533 1.533 . . . . 0.0 112.813 -178.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -79.99 172.54 13.63 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 121.63 -0.669 . . . . 0.0 110.934 168.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -153.44 102.44 0.22 Allowed Glycine 0 N--CA 1.469 0.841 0 O-C-N 121.373 -0.829 . . . . 0.0 114.252 177.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -150.12 85.62 1.41 Allowed 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 126.805 2.042 . . . . 0.0 107.384 170.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.1 mpp? 67.22 135.46 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 131.49 3.916 . . . . 0.0 116.256 176.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -161.76 169.34 21.59 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.138 1.375 . . . . 0.0 112.788 177.309 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 82.1 p -91.09 171.65 9.11 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 126.55 1.94 . . . . 0.0 111.954 172.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -51.19 -42.23 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.317 0 O-C-N 121.288 -0.883 . . . . 0.0 111.537 172.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -62.57 -48.19 80.53 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.367 1.067 . . . . 0.0 112.544 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -73.64 -31.56 63.57 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -178.475 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 57.9 t -64.91 -46.31 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 O-C-N 121.615 -0.678 . . . . 0.0 110.647 169.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.9 ttm -69.29 -32.67 71.98 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 126.2 1.8 . . . . 0.0 114.114 -177.345 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -51.48 -49.7 61.3 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 122.974 0.51 . . . . 0.0 111.137 169.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 42.3 m-85 -74.71 -36.7 62.69 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 115.04 1.496 . . . . 0.0 115.04 171.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.1 mp -71.77 -36.95 70.52 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 120.87 1.668 . . . . 0.0 113.435 -177.42 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.13 -42.1 99.56 Favored Glycine 0 CA--C 1.533 1.18 0 CA-C-N 119.246 0.93 . . . . 0.0 111.688 170.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.9 tp60 -62.14 -42.69 99.5 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.644 1.178 . . . . 0.0 112.317 172.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 50.4 t80 -62.17 -52.34 64.2 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.743 1.217 . . . . 0.0 110.2 176.432 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 69.0 mt -58.68 -39.61 76.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 C-N-CA 123.954 0.902 . . . . 0.0 110.752 178.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.3 tpt -65.8 -44.19 86.41 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.351 1.06 . . . . 0.0 112.902 175.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.0 p -78.49 -27.77 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 CA-C-N 119.809 1.186 . . . . 0.0 113.399 -177.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 54.4 mmtt -89.73 -15.74 31.83 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.108 1.363 . . . . 0.0 113.268 173.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 13.9 mp0 51.86 57.88 6.05 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.815 2.046 . . . . 0.0 112.268 -171.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 13.8 tp -91.88 0.93 57.46 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.393 1.077 . . . . 0.0 112.533 -174.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 41.5 p90 -92.62 156.43 17.1 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.854 1.662 . . . . 0.0 111.177 171.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -80.41 122.71 27.3 Favored 'General case' 0 CA--C 1.541 0.634 0 O-C-N 121.579 -0.7 . . . . 0.0 110.86 172.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -59.53 -23.85 63.18 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 114.683 1.364 . . . . 0.0 114.683 177.842 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -91.35 -27.81 18.12 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 123.96 0.904 . . . . 0.0 112.154 -173.443 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -147.03 87.73 1.7 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.844 2.457 . . . . 0.0 109.605 178.328 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 29.6 mp0 -64.43 -12.03 39.22 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 -169.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 28.1 p80 -65.66 -24.79 67.11 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 170.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 20.6 tpp -86.14 132.02 34.12 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.239 1.416 . . . . 0.0 111.629 177.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 3.7 t -127.09 125.71 66.85 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 C-N-CA 127.01 2.124 . . . . 0.0 109.49 178.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 23.2 t80 -101.14 46.84 0.93 Allowed 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.64 1.176 . . . . 0.0 113.244 -169.626 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 85.2 m -64.88 -9.65 22.58 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 120.467 -1.396 . . . . 0.0 113.848 -179.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -54.98 -22.79 29.13 Favored Glycine 0 CA--C 1.541 1.687 0 C-N-CA 124.78 1.181 . . . . 0.0 113.776 169.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -86.72 1.98 87.15 Favored Glycine 0 CA--C 1.541 1.71 0 C-N-CA 125.228 1.394 . . . . 0.0 116.148 173.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -131.69 -173.62 3.18 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 120.1 1.95 . . . . 0.0 113.769 -175.217 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 7.5 mp -47.15 -40.52 15.89 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.949 1.699 . . . . 0.0 113.532 179.081 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.5 tp -68.57 -32.4 72.29 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-O 121.617 0.722 . . . . 0.0 111.256 178.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -73.15 -36.0 56.74 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 126.64 2.067 . . . . 0.0 114.51 173.442 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -66.37 -42.36 88.09 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.861 1.83 . . . . 0.0 110.161 170.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 27.7 tp -59.25 -51.45 69.93 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.677 1.191 . . . . 0.0 112.332 178.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.22 -10.98 26.74 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 114.91 1.448 . . . . 0.0 114.91 -177.303 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.0 -20.04 7.06 Favored Glycine 0 CA--C 1.539 1.584 0 C-N-CA 125.931 1.729 . . . . 0.0 115.638 -179.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.09 30.57 0.49 Allowed 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -175.207 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 5.6 tp60 -70.45 44.79 0.08 Allowed 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 116.4 2.0 . . . . 0.0 116.4 -168.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 21.2 m -105.61 138.36 41.94 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 120.778 -1.201 . . . . 0.0 108.973 169.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . 0.405 ' CG ' ' HE3' ' A' ' 101' ' ' MET . 45.7 p90 -157.24 167.94 28.87 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 -167.528 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 50.1 m -115.09 136.02 53.57 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 113.936 -1.484 . . . . 0.0 109.841 175.3 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 24.4 m -77.53 -20.05 14.05 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.344 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -178.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -74.8 -6.25 47.94 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 126.484 1.913 . . . . 0.0 115.171 -178.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -121.16 87.89 44.66 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 126.439 1.896 . . . . 0.0 109.476 -177.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -63.33 -31.34 73.35 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 123.93 3.086 . . . . 0.0 115.273 -169.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 70.0 m -61.5 -55.91 38.34 Favored Pre-proline 0 N--CA 1.477 0.89 0 CA-C-N 120.12 1.327 . . . . 0.0 113.825 -177.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -67.17 -27.17 41.81 Favored 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 121.817 1.678 . . . . 0.0 112.63 175.219 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 27.9 tp -65.55 -45.93 81.5 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.634 0.774 . . . . 0.0 111.158 175.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -63.48 -36.33 83.4 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.627 -0.671 . . . . 0.0 112.564 173.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -59.92 -46.3 89.8 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 119.355 0.98 . . . . 0.0 112.079 176.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.405 ' HE3' ' CG ' ' A' ' 90' ' ' PHE . 29.0 mtm -62.09 -49.86 74.25 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 171.637 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -64.94 -46.76 80.23 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 118.042 -0.98 . . . . 0.0 111.053 -171.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -58.19 -23.6 56.11 Favored 'General case' 0 N--CA 1.482 1.14 0 CA-C-N 119.975 1.261 . . . . 0.0 113.338 175.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -90.49 -18.74 24.78 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.968 1.707 . . . . 0.0 114.806 174.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -121.86 -26.68 4.78 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-N 119.843 1.201 . . . . 0.0 114.145 -171.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 3.3 tt -124.79 96.2 4.8 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 127.631 2.373 . . . . 0.0 107.188 174.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 33.5 t -58.58 132.24 23.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 C-N-CA 123.623 0.769 . . . . 0.0 111.069 -170.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 6.3 t -148.28 -174.76 4.67 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.152 1.381 . . . . 0.0 111.948 -172.42 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -91.88 26.86 2.27 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.498 1.919 . . . . 0.0 115.503 -168.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -139.12 157.14 46.48 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.825 1.25 . . . . 0.0 114.269 -172.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 8.9 t . . . . . 0 N--CA 1.479 0.992 0 C-N-CA 125.651 1.58 . . . . 0.0 113.795 -176.159 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 200' ' ' 44Z . . . . . 0.407 ' CD3' ' CG1' ' A' ' 200' ' ' 44Z . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 . . . . . 0 CA--C 1.542 0.671 0 N-CA-C 112.489 0.551 . . . . 0.0 112.489 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.7 mt -133.04 151.56 34.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 125.873 1.669 . . . . 0.0 109.558 -179.275 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 69.2 m-80 -107.74 49.85 0.79 Allowed 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.424 1.49 . . . . 0.0 111.036 172.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 7.9 pm0 -80.75 166.63 20.82 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.669 1.587 . . . . 0.0 113.209 -176.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 17.8 m -131.66 157.48 43.17 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 125.573 1.549 . . . . 0.0 113.526 -169.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 30.9 ttm105 -86.69 143.1 35.26 Favored Pre-proline 0 N--CA 1.48 1.075 0 C-N-CA 124.796 1.238 . . . . 0.0 112.56 -172.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -65.81 166.83 19.09 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 122.606 2.204 . . . . 0.0 111.953 168.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 27.8 ttpt -72.53 157.67 37.15 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 170.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.3 mp -50.4 -47.5 83.27 Favored Pre-proline 0 N--CA 1.473 0.696 0 N-CA-C 115.252 1.575 . . . . 0.0 115.252 -168.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_exo -66.19 -28.99 47.79 Favored 'Trans proline' 0 C--N 1.348 0.522 0 CA-C-N 121.689 1.639 . . . . 0.0 113.732 178.414 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.4 tt -74.11 -38.62 63.77 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.37 -0.831 . . . . 0.0 109.606 177.266 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 23.1 tp -60.2 -35.59 75.75 Favored 'General case' 0 CA--C 1.55 0.956 0 O-C-N 121.521 -0.737 . . . . 0.0 111.341 170.115 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.4 mmtp -69.62 -36.51 76.21 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 121.386 -0.821 . . . . 0.0 112.552 174.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.29 -38.65 81.66 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.495 0.718 . . . . 0.0 110.921 170.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.5 mp -64.13 -39.95 95.14 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.029 -1.045 . . . . 0.0 113.116 171.155 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 35.6 m170 -58.81 -47.32 85.17 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 119.592 1.087 . . . . 0.0 111.497 170.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.16 -25.15 68.22 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 177.098 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.62 -15.22 63.54 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.067 0.947 . . . . 0.0 113.322 172.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 89.47 12.59 62.68 Favored Glycine 0 CA--C 1.537 1.413 0 C-N-CA 125.06 1.314 . . . . 0.0 113.883 -169.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -98.67 157.5 16.22 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.893 1.277 . . . . 0.0 111.662 176.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.8 tp60 -80.38 164.42 23.11 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.658 0.783 . . . . 0.0 111.36 174.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -82.08 -156.78 18.86 Favored Glycine 0 CA--C 1.537 1.462 0 N-CA-C 115.809 1.084 . . . . 0.0 115.809 174.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 61.0 66.16 0.93 Allowed 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 127.611 2.364 . . . . 0.0 116.592 173.39 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . 0.401 0.9 OUTLIER 51.38 146.05 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.275 1 N-CA-C 121.967 4.062 . . . . 0.0 121.967 168.307 . . . . . . . . 4 3 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -157.53 172.15 19.08 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.559 1.543 . . . . 0.0 112.596 -168.416 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 40.0 p -81.66 168.78 17.77 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 124.475 1.11 . . . . 0.0 112.067 171.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -57.92 -41.06 79.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 120.22 -1.55 . . . . 0.0 110.663 172.406 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -59.42 -31.77 69.58 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.666 0.786 . . . . 0.0 112.709 178.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -80.55 -53.16 6.81 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.082 0.953 . . . . 0.0 112.903 170.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 88.5 t -56.08 -52.3 51.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 123.776 0.83 . . . . 0.0 111.275 -176.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.411 ' HA ' ' HE3' ' A' ' 53' ' ' MET . 26.7 mmm -73.15 -30.64 63.73 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -172.399 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 54.9 t-80 -61.58 -48.24 81.83 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.583 170.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -64.54 -38.95 92.79 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 121.743 -0.598 . . . . 0.0 112.389 173.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.98 -38.78 92.11 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 121.187 -0.946 . . . . 0.0 111.448 175.055 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.74 -39.14 97.17 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 125.385 1.469 . . . . 0.0 112.885 172.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 11.9 tp60 -60.94 -48.64 80.87 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.757 1.223 . . . . 0.0 111.091 169.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -56.54 -48.96 76.17 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.122 -0.986 . . . . 0.0 110.735 174.218 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 47.0 mt -59.63 -36.76 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 125.228 1.411 . . . . 0.0 111.935 177.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.5 tpt -68.12 -36.5 79.84 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.718 1.207 . . . . 0.0 112.231 174.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 94.2 t -78.18 -33.41 17.84 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 124.063 0.945 . . . . 0.0 112.677 178.458 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 48.2 mmtt -89.84 -14.82 33.56 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.752 1.221 . . . . 0.0 113.222 178.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.6 mp0 50.02 63.94 1.99 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 127.627 2.371 . . . . 0.0 113.088 -171.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 14.3 tp -91.26 -1.59 57.64 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.149 0.98 . . . . 0.0 113.295 -175.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 55.1 p90 -90.25 156.22 18.45 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.551 1.54 . . . . 0.0 111.923 178.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -76.83 128.64 34.97 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.816 -0.553 . . . . 0.0 111.136 171.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.6 pm0 -69.68 -27.22 64.83 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 115.271 1.582 . . . . 0.0 115.271 -171.171 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -96.08 -26.92 15.32 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 119.165 0.893 . . . . 0.0 111.891 -177.315 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -136.19 79.75 1.79 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.669 1.988 . . . . 0.0 111.178 176.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 29.7 mp0 -60.89 -12.73 12.0 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -173.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 23.9 p80 -62.38 -25.76 68.1 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 118.94 0.791 . . . . 0.0 112.786 170.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 18.2 tpp -83.6 129.17 34.96 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.069 1.347 . . . . 0.0 110.955 172.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.4 t -119.01 117.57 54.73 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 125.991 1.716 . . . . 0.0 107.856 174.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -102.09 65.74 0.99 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.213 1.005 . . . . 0.0 112.165 -169.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 2.7 m -79.32 3.91 16.77 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 114.258 1.207 . . . . 0.0 114.258 -173.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.95 -26.08 54.48 Favored Glycine 0 CA--C 1.542 1.727 0 CA-C-N 119.927 1.24 . . . . 0.0 114.316 171.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -91.68 7.34 79.68 Favored Glycine 0 CA--C 1.542 1.738 0 C-N-CA 125.437 1.494 . . . . 0.0 115.374 172.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -112.74 170.31 8.28 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.181 1.792 . . . . 0.0 112.537 -174.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.9 tt -46.53 -43.17 16.72 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.63 1.572 . . . . 0.0 111.089 169.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 96.3 mt -55.13 -43.23 73.93 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.248 1.019 . . . . 0.0 112.522 173.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -70.64 -39.1 67.61 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 124.984 1.278 . . . . 0.0 113.62 177.275 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -63.52 -42.61 98.46 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 120.363 2.082 . . . . 0.0 110.696 174.074 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 40.2 tp -62.7 -51.59 66.6 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.976 1.711 . . . . 0.0 112.52 -178.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -97.26 -8.48 29.73 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 -176.251 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 82.69 -24.68 4.94 Favored Glycine 0 CA--C 1.54 1.613 0 C-N-CA 125.492 1.52 . . . . 0.0 113.126 -169.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.18 137.21 10.39 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 127.049 2.14 . . . . 0.0 111.611 175.588 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -148.44 45.1 1.04 Allowed 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.153 0.981 . . . . 0.0 110.161 169.05 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 11.5 m -99.51 131.17 45.69 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 120.933 -1.104 . . . . 0.0 110.368 170.115 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 35.7 p90 -165.16 178.78 6.74 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.589 1.555 . . . . 0.0 111.98 -168.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 77.3 p -127.21 143.88 51.16 Favored 'General case' 0 N--CA 1.456 -0.162 0 N-CA-C 114.63 1.345 . . . . 0.0 114.63 174.157 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.3 m -72.1 -16.84 18.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 N-CA-C 114.042 1.127 . . . . 0.0 114.042 -173.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.5 pttt -74.43 -9.49 58.64 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.854 1.662 . . . . 0.0 114.108 172.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -121.09 79.84 34.59 Favored Pre-proline 0 CA--C 1.549 0.906 0 C-N-CA 126.091 1.757 . . . . 0.0 110.154 -179.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.14 -28.52 28.11 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 123.449 2.766 . . . . 0.0 114.712 -169.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 59.2 m -57.51 -54.14 58.17 Favored Pre-proline 0 N--CA 1.477 0.882 0 CA-C-N 120.147 1.339 . . . . 0.0 113.721 -177.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -66.16 -27.26 49.17 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 121.889 1.726 . . . . 0.0 112.854 174.323 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.21 -53.41 57.31 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.255 1.022 . . . . 0.0 110.568 175.295 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -63.77 -32.45 73.96 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.72 0.808 . . . . 0.0 112.52 173.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -62.47 -43.85 97.81 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 120.123 1.329 . . . . 0.0 112.844 175.116 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 23.5 mtm -63.5 -49.67 72.64 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.023 0.529 . . . . 0.0 111.729 171.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.8 mp -62.43 -36.78 83.46 Favored 'General case' 0 C--O 1.219 -0.547 0 CA-C-O 117.696 -1.145 . . . . 0.0 111.808 -177.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 -55.1 -24.49 25.9 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 121.336 1.88 . . . . 0.0 113.662 171.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -89.99 -15.08 32.65 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 125.367 1.467 . . . . 0.0 114.559 173.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -132.37 2.69 3.88 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 115.595 1.702 . . . . 0.0 115.595 -177.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 62.0 tp -145.78 143.36 29.65 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 128.251 2.62 . . . . 0.0 108.573 -178.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 65.2 t -75.96 95.49 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 171.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 5.9 t -156.55 -174.14 4.8 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.432 1.493 . . . . 0.0 111.767 -175.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -104.35 169.54 8.42 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 127.386 2.275 . . . . 0.0 110.626 -176.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -84.53 4.57 31.36 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 115.712 1.745 . . . . 0.0 115.712 -174.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 78.1 p . . . . . 0 N--CA 1.471 0.588 0 C-N-CA 125.454 1.501 . . . . 0.0 112.17 -168.167 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 200' ' ' 44Z . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 . . . . . 0 CA--C 1.542 0.672 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 57.7 mt -109.76 138.69 36.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 125.4 1.48 . . . . 0.0 109.686 -179.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 51.4 t-20 -76.26 110.35 10.7 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.793 0.837 . . . . 0.0 110.609 173.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -151.98 171.84 17.19 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.821 1.648 . . . . 0.0 111.827 -179.407 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.6 m -127.77 172.2 14.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 126.252 1.821 . . . . 0.0 111.84 -178.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -81.8 140.91 47.34 Favored Pre-proline 0 N--CA 1.481 1.121 0 C-N-CA 124.547 1.139 . . . . 0.0 112.941 -169.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -70.28 175.6 8.31 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 123.793 2.995 . . . . 0.0 113.791 175.003 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 17.3 ttmt -60.56 147.27 42.14 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.564 1.145 . . . . 0.0 109.617 172.253 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 73.6 mt -57.12 -47.05 99.73 Favored Pre-proline 0 N--CA 1.474 0.744 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 -167.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -66.82 -23.63 47.71 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 CA-C-N 121.8 1.679 . . . . 0.0 114.609 176.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 5.6 tt -65.92 -44.11 86.12 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 120.057 1.299 . . . . 0.0 109.31 172.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 36.6 tp -62.13 -39.99 94.42 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 121.738 -0.601 . . . . 0.0 111.729 172.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.8 mmpt? -61.28 -39.81 91.81 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.339 0.655 . . . . 0.0 112.698 174.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 63.5 mt -64.33 -35.56 74.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 124.355 1.062 . . . . 0.0 112.224 174.402 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.1 mt -70.65 -34.87 72.51 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 119.666 1.121 . . . . 0.0 111.944 171.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 50.9 m170 -61.19 -42.32 98.36 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.053 0.842 . . . . 0.0 111.275 169.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.66 -24.86 67.72 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.512 1.125 . . . . 0.0 113.513 175.023 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.51 -7.02 44.91 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 124.155 0.982 . . . . 0.0 113.141 171.284 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 85.49 12.78 71.92 Favored Glycine 0 CA--C 1.537 1.421 0 C-N-CA 125.205 1.383 . . . . 0.0 114.146 -173.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -106.3 140.9 38.51 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.955 1.302 . . . . 0.0 112.637 -176.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -76.66 162.55 27.64 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 121.721 -0.612 . . . . 0.0 110.479 169.036 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -162.99 130.42 2.24 Favored Glycine 0 CA--C 1.526 0.747 0 O-C-N 121.432 -0.792 . . . . 0.0 114.982 -178.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -142.17 66.68 1.33 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 126.227 1.811 . . . . 0.0 109.162 173.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . 0.419 0.6 OUTLIER 63.38 145.86 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 129.537 3.135 . . . . 0.0 118.191 -175.013 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -162.72 169.55 19.81 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.089 1.756 . . . . 0.0 113.07 -168.745 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 41.8 p -79.96 171.37 15.19 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 125.244 1.418 . . . . 0.0 112.01 169.5 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -59.52 -39.19 78.68 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 O-C-N 120.549 -1.345 . . . . 0.0 111.676 173.736 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -62.18 -45.57 92.82 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.272 1.429 . . . . 0.0 112.724 176.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -68.76 -38.88 80.42 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.259 0.624 . . . . 0.0 112.176 176.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 8.5 t -58.37 -45.3 89.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 124.689 1.196 . . . . 0.0 111.126 170.177 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -69.3 -33.97 73.98 Favored 'General case' 0 CA--C 1.519 -0.242 0 C-N-CA 126.942 2.097 . . . . 0.0 114.512 -172.425 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -51.56 -49.29 62.32 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 120.699 0.285 . . . . 0.0 111.149 169.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -74.77 -32.26 62.01 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 172.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.91 -40.79 78.89 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 120.431 1.469 . . . . 0.0 112.43 178.873 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -60.18 -45.62 95.71 Favored Glycine 0 CA--C 1.529 0.919 0 N-CA-C 111.269 -0.732 . . . . 0.0 111.269 171.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 11.0 tp60 -58.32 -42.61 87.12 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.269 1.028 . . . . 0.0 112.582 173.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -61.13 -50.12 74.48 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.078 0.951 . . . . 0.0 110.544 174.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 72.4 mt -61.44 -37.13 77.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 123.781 0.833 . . . . 0.0 111.154 178.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 34.3 mmt -67.58 -42.97 81.65 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 119.502 1.046 . . . . 0.0 113.256 174.183 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.3 p -78.49 -27.42 14.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 CA-C-N 119.738 1.154 . . . . 0.0 113.267 -176.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 56.4 mmtt -93.24 -15.69 25.6 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.266 1.427 . . . . 0.0 113.566 174.134 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 14.8 mp0 54.36 61.29 3.09 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.68 1.992 . . . . 0.0 113.022 -175.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.2 tp -94.4 10.12 35.6 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.48 1.112 . . . . 0.0 112.873 -176.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 25.1 p90 -113.26 155.43 25.1 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 127.128 2.171 . . . . 0.0 111.49 -178.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -80.96 129.64 34.63 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 122.048 -0.408 . . . . 0.0 110.174 169.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 7.7 pm0 -59.02 -33.88 71.24 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -173.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -108.02 -27.88 9.88 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.498 1.119 . . . . 0.0 112.185 -171.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -109.14 56.5 0.62 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.763 2.025 . . . . 0.0 111.019 171.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -60.71 -18.63 55.43 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 124.494 1.118 . . . . 0.0 113.434 -175.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 29.6 p80 -63.26 -14.8 53.56 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.584 1.154 . . . . 0.0 114.013 171.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 13.8 ttm -111.64 141.72 44.87 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.007 1.323 . . . . 0.0 112.132 172.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.5 t -122.99 133.3 69.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 126.258 1.823 . . . . 0.0 108.821 175.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 6.6 t80 -113.32 52.07 0.81 Allowed 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.77 0.795 . . . . 0.0 112.968 -169.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 4.9 m -71.52 -6.37 40.12 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 -175.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -55.54 -25.54 42.69 Favored Glycine 0 CA--C 1.541 1.657 0 C-N-CA 125.439 1.495 . . . . 0.0 115.148 177.165 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -88.47 0.24 82.95 Favored Glycine 0 CA--C 1.541 1.658 0 C-N-CA 125.051 1.31 . . . . 0.0 115.601 175.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -131.92 -176.07 3.93 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 126.067 1.747 . . . . 0.0 112.072 -171.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -46.71 -47.05 20.55 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.833 2.053 . . . . 0.0 113.871 -170.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 94.0 mt -60.08 -37.81 81.03 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.81 1.244 . . . . 0.0 112.564 175.162 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -73.16 -34.24 58.42 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 125.697 1.617 . . . . 0.0 114.311 175.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -66.51 -42.39 87.42 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 119.68 1.74 . . . . 0.0 110.444 171.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 32.9 tp -61.53 -50.77 71.33 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.401 1.48 . . . . 0.0 112.524 179.049 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -99.02 -14.27 19.53 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 115.154 1.538 . . . . 0.0 115.154 -175.442 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 82.35 -19.1 11.37 Favored Glycine 0 CA--C 1.541 1.665 0 C-N-CA 125.729 1.633 . . . . 0.0 116.114 179.448 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.0 24.12 1.18 Allowed 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 -176.794 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -71.26 52.65 0.18 Allowed 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 117.533 2.42 . . . . 0.0 117.533 -167.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 36.0 m -117.79 139.06 51.6 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.235 1.014 . . . . 0.0 108.53 168.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 45.8 p90 -159.34 167.12 29.66 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -167.245 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 2.1 m -99.91 136.29 40.05 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.608 1.563 . . . . 0.0 110.328 169.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 6.9 m -77.6 -19.87 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 124.399 1.079 . . . . 0.0 112.803 175.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 61.3 pttt -80.56 -2.94 48.38 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 127.592 2.357 . . . . 0.0 115.114 -179.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -125.94 94.26 42.17 Favored Pre-proline 0 CA--C 1.549 0.92 0 C-N-CA 126.592 1.957 . . . . 0.0 110.267 -171.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -61.5 -31.39 87.66 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 123.936 3.091 . . . . 0.0 115.529 -174.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 66.8 m -58.53 -53.1 69.65 Favored Pre-proline 0 N--CA 1.477 0.882 0 CA-C-N 119.92 1.236 . . . . 0.0 114.057 -178.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -68.39 -24.33 36.99 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 122.034 1.823 . . . . 0.0 113.49 174.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 61.5 mt -65.9 -47.08 75.99 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 119.522 1.055 . . . . 0.0 111.058 174.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -58.13 -41.3 83.36 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 178.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -58.74 -51.72 68.77 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 118.963 0.801 . . . . 0.0 112.487 176.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 34.0 mtm -64.16 -49.69 71.09 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.266 0.626 . . . . 0.0 112.287 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.4 mp -63.61 -49.38 73.54 Favored 'General case' 0 C--O 1.224 -0.263 0 C-N-CA 124.568 1.147 . . . . 0.0 110.756 -176.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -60.32 -19.21 54.39 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 120.238 1.381 . . . . 0.0 113.647 178.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -96.74 -14.14 22.21 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.948 1.699 . . . . 0.0 114.435 175.126 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -118.23 -21.39 8.19 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-N 120.047 1.294 . . . . 0.0 113.742 -178.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 43.8 tp -117.36 130.17 56.34 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 127.225 2.21 . . . . 0.0 107.787 169.26 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 62.0 t -71.15 109.44 3.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 175.018 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 10.8 t -157.45 169.14 25.37 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 125.178 1.391 . . . . 0.0 111.537 -178.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -79.08 171.75 14.76 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.367 1.467 . . . . 0.0 114.258 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -120.64 15.1 11.89 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.827 1.651 . . . . 0.0 114.771 -169.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 8.0 t . . . . . 0 N--CA 1.479 1.003 0 C-N-CA 125.462 1.505 . . . . 0.0 112.955 -174.792 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 200' ' ' 44Z . . . . . 0.421 ' CD3' ' CG1' ' A' ' 200' ' ' 44Z . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 54.3 mm-40 . . . . . 0 CA--C 1.538 0.511 0 CA-C-O 122.123 0.964 . . . . 0.0 112.794 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 17.4 pt -80.62 163.79 3.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 127.787 2.435 . . . . 0.0 114.29 -175.018 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 40.7 p-10 -86.94 2.49 49.19 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 125.57 1.548 . . . . 0.0 114.356 175.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 30.4 mm100 -78.34 174.58 11.1 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.554 1.541 . . . . 0.0 111.873 175.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 35.0 m -124.47 172.09 12.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 125.398 1.479 . . . . 0.0 111.904 -173.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 37.6 mtm180 -91.39 145.25 31.04 Favored Pre-proline 0 N--CA 1.479 1.01 0 C-N-CA 124.405 1.082 . . . . 0.0 112.482 -175.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -75.78 177.92 8.09 Favored 'Trans proline' 0 CA--C 1.54 0.807 0 C-N-CA 124.152 3.235 . . . . 0.0 111.499 169.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.7 ttmt -69.24 148.53 49.68 Favored 'General case' 0 CA--C 1.536 0.442 0 O-C-N 121.638 -0.664 . . . . 0.0 111.237 178.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 10.0 mp -53.67 -55.17 38.17 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 125.133 1.373 . . . . 0.0 114.548 -169.236 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -65.46 -22.0 59.7 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 122.297 1.998 . . . . 0.0 113.845 175.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.0 tt -75.21 -32.41 61.18 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 119.88 1.218 . . . . 0.0 110.988 172.573 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.3 tp -63.69 -37.31 86.88 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.308 -0.87 . . . . 0.0 111.017 169.189 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 8.9 mmpt? -62.61 -37.62 86.96 Favored 'General case' 0 N--CA 1.479 0.998 0 O-C-N 121.674 -0.641 . . . . 0.0 112.34 173.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 90.4 mt -62.94 -39.0 83.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 124.067 0.947 . . . . 0.0 111.467 172.507 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.3 mp -70.35 -33.06 71.01 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 120.715 -1.241 . . . . 0.0 113.332 172.175 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 63.5 m170 -64.46 -41.36 96.56 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 120.957 -1.09 . . . . 0.0 111.401 170.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.28 -24.12 67.72 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.013 0.925 . . . . 0.0 113.323 172.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.09 -9.12 57.97 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 123.955 0.902 . . . . 0.0 113.425 172.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.51 7.75 64.75 Favored Glycine 0 CA--C 1.538 1.491 0 C-N-CA 125.4 1.476 . . . . 0.0 114.572 -175.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -94.08 166.54 12.08 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.67 1.188 . . . . 0.0 113.08 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.1 tm0? -126.53 144.53 50.84 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.839 1.656 . . . . 0.0 108.973 169.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -174.71 165.48 36.79 Favored Glycine 0 C--N 1.339 0.711 0 N-CA-C 116.496 1.358 . . . . 0.0 116.496 -170.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -141.26 -65.38 0.43 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.408 1.883 . . . . 0.0 109.18 169.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 25.9 mtm -106.29 142.76 35.43 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 127.811 2.445 . . . . 0.0 112.169 -178.069 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -157.4 162.95 39.03 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.062 0.945 . . . . 0.0 113.419 -173.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 81.2 p -94.97 172.85 7.9 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.613 1.165 . . . . 0.0 108.366 166.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -57.4 -46.88 85.62 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.426 0 O-C-N 120.082 -1.636 . . . . 0.0 109.817 169.45 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -55.97 -39.89 72.45 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.786 1.234 . . . . 0.0 112.649 -179.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -74.2 -37.29 63.93 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 175.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 97.0 t -68.71 -49.66 62.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 CA-C-N 119.946 1.248 . . . . 0.0 111.978 175.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.415 ' HA ' ' HE3' ' A' ' 53' ' ' MET . 11.5 mmm -67.63 -28.05 67.4 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 119.229 0.922 . . . . 0.0 112.99 -170.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -53.44 -54.03 42.77 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 114.84 -1.073 . . . . 0.0 111.355 169.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -74.35 -35.22 63.57 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 176.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.32 -37.56 77.79 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 121.131 -0.98 . . . . 0.0 112.107 178.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -64.99 -42.82 96.6 Favored Glycine 0 CA--C 1.529 0.929 0 C-N-CA 124.588 1.09 . . . . 0.0 112.054 172.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 30.4 tp60 -57.94 -44.54 87.01 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.046 0.938 . . . . 0.0 111.641 169.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 70.9 t80 -60.86 -52.18 66.13 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.505 0.722 . . . . 0.0 111.304 176.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 25.8 mt -58.79 -36.83 62.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 124.376 1.07 . . . . 0.0 111.371 177.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.6 tpt -66.39 -45.04 81.38 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 125.206 1.402 . . . . 0.0 112.684 175.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.7 p -78.51 -27.28 14.14 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 CA-C-N 119.709 1.14 . . . . 0.0 113.488 -177.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 53.7 mmtt -90.97 -15.74 29.18 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 125.287 1.435 . . . . 0.0 113.494 173.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 16.0 mp0 54.69 63.94 1.98 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 127.412 2.285 . . . . 0.0 113.417 -175.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.7 mt -91.86 -8.13 47.38 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.59 0.756 . . . . 0.0 113.007 176.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 54.2 p90 -76.61 153.39 35.32 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.845 0.858 . . . . 0.0 111.072 170.028 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -82.82 130.81 35.18 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 121.719 -0.613 . . . . 0.0 110.828 171.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -64.11 -25.36 68.06 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 120.969 -1.082 . . . . 0.0 113.353 -177.73 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -91.69 -22.72 20.09 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 123.923 0.889 . . . . 0.0 111.671 -172.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -149.84 75.42 1.25 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 129.327 3.051 . . . . 0.0 109.662 -174.067 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 29.9 mp0 -60.7 -18.64 55.42 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -173.405 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 1.6 p-80 -63.7 -29.74 70.93 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 113.469 0.915 . . . . 0.0 113.469 169.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 16.9 tpp -81.35 130.01 34.86 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.515 1.126 . . . . 0.0 110.532 171.584 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.5 t -124.81 117.38 50.1 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 C-N-CA 126.099 1.76 . . . . 0.0 108.664 177.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -96.77 73.53 2.65 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.165 1.386 . . . . 0.0 110.713 -177.163 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 72.5 m -76.76 -0.81 25.16 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 121.208 -0.932 . . . . 0.0 112.944 171.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.58 -25.63 58.62 Favored Glycine 0 CA--C 1.541 1.685 0 O-C-N 120.557 -1.34 . . . . 0.0 113.879 169.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -87.56 3.77 86.19 Favored Glycine 0 CA--C 1.542 1.731 0 C-N-CA 125.32 1.438 . . . . 0.0 115.224 171.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -107.57 167.51 9.9 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 126.231 1.812 . . . . 0.0 112.438 -176.372 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.9 tp -46.61 -43.0 17.0 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.184 1.794 . . . . 0.0 111.917 169.152 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 13.9 tp -59.38 -41.35 89.15 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.412 1.485 . . . . 0.0 111.74 175.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -65.16 -42.35 96.49 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 124.935 1.255 . . . . 0.0 113.834 171.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -63.33 -47.31 82.74 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 120.211 2.006 . . . . 0.0 110.679 177.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.4 pp -70.36 -32.49 70.2 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -176.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.15 -9.04 31.58 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 119.783 1.174 . . . . 0.0 112.854 175.228 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 80.43 -26.5 3.03 Favored Glycine 0 CA--C 1.541 1.659 0 C-N-CA 125.909 1.718 . . . . 0.0 113.437 -171.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -161.27 134.84 6.61 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 128.741 2.817 . . . . 0.0 109.425 176.25 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -142.6 28.56 1.61 Allowed 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 119.132 0.878 . . . . 0.0 111.32 174.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.2 m -91.78 142.69 27.31 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 121.591 -0.693 . . . . 0.0 111.95 -178.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 50.0 p90 -160.97 169.44 22.56 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.315 1.046 . . . . 0.0 112.41 -169.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 5.3 t -125.01 136.49 53.76 Favored 'General case' 0 N--CA 1.462 0.148 0 C-N-CA 123.584 0.754 . . . . 0.0 110.755 169.305 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 33.9 m -71.35 -11.69 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 N-CA-C 114.325 1.231 . . . . 0.0 114.325 -174.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -73.88 -11.21 60.29 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.338 1.055 . . . . 0.0 113.549 169.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 47.0 t0 -121.39 77.71 35.36 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 126.9 2.08 . . . . 0.0 109.303 179.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -71.39 -28.26 18.29 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 123.478 2.786 . . . . 0.0 115.017 -169.347 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 49.8 m -57.35 -52.26 75.56 Favored Pre-proline 0 N--CA 1.477 0.898 0 CA-C-N 119.987 1.267 . . . . 0.0 114.25 -177.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -66.47 -30.63 43.54 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 122.193 1.929 . . . . 0.0 113.239 176.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 40.8 tp -65.55 -48.29 72.93 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.281 1.032 . . . . 0.0 110.312 175.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -60.45 -41.48 94.17 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 118.484 -0.769 . . . . 0.0 112.405 172.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -58.28 -47.53 83.34 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 120.128 1.331 . . . . 0.0 112.645 -179.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 46.0 mtm -66.32 -49.6 66.46 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.461 0.705 . . . . 0.0 112.314 175.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.7 mp -65.58 -37.16 85.87 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-O 117.957 -1.021 . . . . 0.0 111.571 -177.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 91.4 mtt180 -55.43 -22.7 21.45 Favored 'General case' 0 N--CA 1.484 1.226 0 CA-C-N 120.732 1.606 . . . . 0.0 113.828 169.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -92.16 -16.24 26.54 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.792 1.637 . . . . 0.0 113.709 175.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -128.72 -10.83 4.96 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 116.185 1.921 . . . . 0.0 116.185 -176.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.1 tt -140.95 164.36 30.46 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.84 2.056 . . . . 0.0 111.315 -167.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 20.8 t -74.81 67.11 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 126.292 1.837 . . . . 0.0 111.117 176.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 16.3 m -108.08 141.89 39.09 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 126.026 1.731 . . . . 0.0 110.082 176.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -89.39 168.09 12.5 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 -178.73 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -126.86 167.73 15.43 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.845 2.058 . . . . 0.0 113.08 -169.439 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 11.8 t . . . . . 0 N--CA 1.479 1.018 0 C-N-CA 124.115 0.966 . . . . 0.0 113.39 175.972 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 200' ' ' 44Z . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 . . . . . 0 CA--C 1.543 0.709 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 38.4 mm -110.06 126.34 67.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 125.151 1.38 . . . . 0.0 110.977 -178.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -140.85 34.94 1.77 Allowed 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 126.894 2.078 . . . . 0.0 110.741 170.325 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -94.37 -179.53 4.95 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 126.107 1.763 . . . . 0.0 112.384 -175.003 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 22.2 m -103.89 163.32 3.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 126.023 1.729 . . . . 0.0 110.907 173.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 43.8 mtt180 -92.24 140.7 24.46 Favored Pre-proline 0 N--CA 1.48 1.027 0 C-N-CA 124.098 0.959 . . . . 0.0 111.502 -176.628 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -76.34 176.72 9.7 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 123.667 2.912 . . . . 0.0 111.327 169.578 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt -68.19 153.39 43.84 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.547 0.739 . . . . 0.0 110.58 179.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 93.5 mt -60.65 -43.9 93.68 Favored Pre-proline 0 N--CA 1.478 0.946 0 N-CA-C 114.543 1.312 . . . . 0.0 114.543 -169.376 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -65.85 -26.2 52.3 Favored 'Trans proline' 0 C--N 1.353 0.794 0 CA-C-N 121.616 1.613 . . . . 0.0 113.287 172.184 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.39 -42.33 75.27 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.437 1.095 . . . . 0.0 110.948 174.776 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.7 tt -61.12 -36.7 80.45 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 120.969 -1.082 . . . . 0.0 111.292 170.042 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -63.77 -37.95 89.27 Favored 'General case' 0 N--CA 1.482 1.154 0 O-C-N 121.082 -1.011 . . . . 0.0 113.394 169.839 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.8 mt -60.26 -41.63 87.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 CA-C-N 120.238 1.381 . . . . 0.0 111.434 171.05 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.8 mp -66.61 -36.71 83.26 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 119.428 1.013 . . . . 0.0 112.133 174.175 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 28.5 m170 -63.36 -43.17 98.43 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 121.046 -1.034 . . . . 0.0 111.674 172.007 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.66 -28.31 69.83 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.266 1.027 . . . . 0.0 113.042 173.539 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.44 -15.07 63.21 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 124.155 0.982 . . . . 0.0 113.302 172.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 102.23 8.17 44.82 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 125.997 1.76 . . . . 0.0 114.884 -176.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -95.95 173.38 7.46 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 118.803 1.301 . . . . 0.0 113.901 -176.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.5 tm0? -136.77 143.28 43.15 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.921 1.688 . . . . 0.0 109.248 169.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.412 ' HA3' ' CZ ' ' A' ' 47' ' ' PHE . . . 169.68 -179.73 41.94 Favored Glycine 0 N--CA 1.467 0.706 0 N-CA-C 115.241 0.856 . . . . 0.0 115.241 179.738 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -139.47 -57.23 0.58 Allowed 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.129 1.772 . . . . 0.0 110.824 -178.068 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 16.0 mtm -103.73 142.01 35.1 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 127.988 2.515 . . . . 0.0 111.257 173.165 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.412 ' CZ ' ' HA3' ' A' ' 44' ' ' GLY . 76.5 m-85 -154.79 144.99 21.9 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.292 1.037 . . . . 0.0 112.662 -176.138 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 43.7 p -76.12 172.04 13.48 Favored 'General case' 0 N--CA 1.484 1.263 0 O-C-N 121.121 -0.987 . . . . 0.0 111.094 168.334 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -56.76 -40.95 73.81 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.258 0 O-C-N 120.718 -1.239 . . . . 0.0 110.683 168.754 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -68.24 -40.76 81.91 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.429 1.092 . . . . 0.0 112.61 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 59.7 mt-10 -66.65 -40.99 88.93 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.591 0.756 . . . . 0.0 111.551 175.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 52.9 t -61.37 -48.58 88.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 O-C-N 121.785 -0.572 . . . . 0.0 110.841 171.525 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.43 -38.12 89.93 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 125.91 1.684 . . . . 0.0 113.955 -176.402 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 85.3 t60 -53.24 -51.6 61.65 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.297 0.639 . . . . 0.0 111.623 171.077 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -74.56 -32.48 62.43 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 176.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -71.85 -39.25 69.84 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.674 1.124 . . . . 0.0 112.564 178.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -60.4 -41.11 98.4 Favored Glycine 0 CA--C 1.536 1.393 0 CA-C-N 119.358 0.981 . . . . 0.0 111.732 171.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.6 tp60 -60.24 -51.37 69.86 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.479 1.512 . . . . 0.0 111.913 170.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 55.6 t80 -58.93 -49.99 75.73 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.0 -1.062 . . . . 0.0 110.397 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 56.7 mt -62.29 -36.51 74.94 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 124.896 1.278 . . . . 0.0 111.373 179.298 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 5.8 tpt -64.58 -40.08 94.89 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 119.6 1.091 . . . . 0.0 112.26 172.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 96.6 t -78.31 -34.08 18.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 124.293 1.037 . . . . 0.0 112.971 -179.052 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 47.4 mmtt -89.11 -15.68 33.31 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.89 1.276 . . . . 0.0 113.06 178.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 14.8 mp0 49.06 69.11 0.61 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.409 2.284 . . . . 0.0 112.601 -171.204 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 9.8 tp -90.74 -1.49 57.85 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.119 0.968 . . . . 0.0 112.776 -176.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -102.09 158.64 16.02 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.861 2.064 . . . . 0.0 111.184 175.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -88.47 127.69 35.52 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 169.117 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.26 -33.21 52.14 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.882 1.068 . . . . 0.0 113.882 179.553 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -90.38 -16.28 29.42 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.577 1.151 . . . . 0.0 112.466 -173.388 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -143.1 64.56 1.35 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 128.059 2.544 . . . . 0.0 109.432 -177.071 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -60.06 -21.82 61.92 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 121.241 -0.912 . . . . 0.0 113.053 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 5.6 p-80 -65.87 -6.55 12.55 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.31 1.444 . . . . 0.0 114.18 169.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 7.2 tpp -117.55 132.12 56.58 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 127.376 2.27 . . . . 0.0 110.379 174.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 11.7 t -115.4 123.28 70.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 126.017 1.727 . . . . 0.0 108.298 175.28 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 81.0 t80 -109.14 103.68 12.72 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.21 1.004 . . . . 0.0 109.913 -178.068 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 73.0 m -95.67 15.11 20.89 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -175.047 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.54 118.8 14.8 Favored Glycine 0 CA--C 1.535 1.334 0 O-C-N 121.468 -0.77 . . . . 0.0 112.093 179.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 76.96 5.62 84.86 Favored Glycine 0 CA--C 1.541 1.717 0 C-N-CA 124.485 1.04 . . . . 0.0 115.512 -175.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -93.79 158.66 15.55 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.189 1.494 . . . . 0.0 112.044 174.51 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 64.6 mt -48.96 -35.38 15.01 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.811 1.244 . . . . 0.0 113.286 177.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -58.88 -45.37 90.38 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.595 0.758 . . . . 0.0 111.743 175.037 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -74.7 -33.93 54.59 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 125.407 1.48 . . . . 0.0 113.902 176.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -59.32 -46.55 88.3 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-N 120.748 2.274 . . . . 0.0 110.096 171.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 32.0 tp -68.88 -51.63 38.16 Favored 'General case' 0 CA--C 1.552 1.054 0 CA-C-N 114.303 -1.317 . . . . 0.0 113.178 -176.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -89.55 -8.34 52.95 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 124.312 1.045 . . . . 0.0 112.608 -177.224 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 83.98 -27.04 4.56 Favored Glycine 0 CA--C 1.541 1.657 0 O-C-N 119.866 -1.771 . . . . 0.0 112.714 -169.566 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.12 140.31 4.39 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 128.55 2.74 . . . . 0.0 110.655 178.288 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -142.76 35.98 1.43 Allowed 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.795 0.838 . . . . 0.0 110.931 169.411 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 5.1 m -86.86 125.01 33.7 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 120.712 -1.242 . . . . 0.0 109.663 169.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -163.6 169.18 18.99 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.176 1.391 . . . . 0.0 111.859 -169.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 13.0 m -115.65 136.14 53.36 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.045 -0.98 . . . . 0.0 111.536 176.173 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -77.76 -14.35 14.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 124.483 1.113 . . . . 0.0 113.519 -169.205 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.2 pttt -75.26 -8.36 56.41 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.478 1.511 . . . . 0.0 114.651 169.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -117.99 83.88 20.05 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 126.394 1.878 . . . . 0.0 110.522 -175.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -67.08 -31.44 36.75 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 123.725 2.95 . . . . 0.0 114.855 -171.677 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 54.5 m -58.32 -51.97 77.96 Favored Pre-proline 0 N--CA 1.476 0.85 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -176.066 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -67.28 -33.98 28.82 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 121.88 1.72 . . . . 0.0 112.58 174.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 8.2 tp -60.38 -46.48 89.82 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.867 1.267 . . . . 0.0 110.878 176.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -56.97 -38.27 72.75 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.294 0.952 . . . . 0.0 112.52 177.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -64.76 -51.46 62.17 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.584 1.084 . . . . 0.0 112.379 177.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -68.52 -29.52 68.13 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 114.06 1.133 . . . . 0.0 114.06 177.538 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 39.7 tp -75.58 -53.54 8.45 Favored 'General case' 0 C--O 1.224 -0.255 0 C-N-CA 126.506 1.922 . . . . 0.0 110.972 178.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 49.9 mtp180 -59.48 -27.39 66.08 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-N 119.42 1.009 . . . . 0.0 113.474 -176.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -75.97 -26.4 56.76 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.297 1.439 . . . . 0.0 113.691 173.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 34.5 m-20 -104.75 -21.54 13.35 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 179.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 21.0 tp -137.05 110.16 7.76 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 127.916 2.487 . . . . 0.0 107.337 171.428 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 15.0 p -66.2 115.5 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-O 121.324 0.583 . . . . 0.0 110.495 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 7.7 t -161.84 -179.17 6.99 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.31 1.444 . . . . 0.0 111.203 -174.159 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -72.15 175.92 5.6 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.709 1.604 . . . . 0.0 114.348 176.749 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -125.56 164.07 21.35 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.295 1.838 . . . . 0.0 112.924 -171.372 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 66.4 p . . . . . 0 N--CA 1.483 1.182 0 C-N-CA 126.707 2.003 . . . . 0.0 113.966 174.167 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 200' ' ' 44Z . . . . . 0.432 ' CD3' ' CG1' ' A' ' 200' ' ' 44Z . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 . . . . . 0 CA--C 1.544 0.712 0 CA-C-O 121.14 0.495 . . . . 0.0 112.281 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.4 pp -71.8 160.75 5.1 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 C-N-CA 125.94 1.696 . . . . 0.0 113.266 177.093 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -81.47 -11.53 59.19 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -178.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 8.2 mm100 -68.4 162.2 25.91 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.831 2.052 . . . . 0.0 114.036 178.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.1 m -132.07 172.11 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 C-N-CA 125.808 1.643 . . . . 0.0 113.332 -169.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 43.4 mtm180 -69.54 146.89 96.5 Favored Pre-proline 0 N--CA 1.486 1.371 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -169.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo -88.9 -177.14 1.56 Allowed 'Trans proline' 0 C--N 1.354 0.823 1 C-N-CA 125.392 4.061 . . . . 0.0 113.447 -176.304 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.0 ttmt -68.03 147.85 51.81 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.745 0.818 . . . . 0.0 109.128 169.182 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 92.4 mt -60.2 -42.07 87.67 Favored Pre-proline 0 N--CA 1.478 0.929 0 N-CA-C 115.354 1.612 . . . . 0.0 115.354 -168.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -59.58 -31.4 94.41 Favored 'Trans proline' 0 CA--C 1.537 0.631 0 CA-C-N 121.76 1.664 . . . . 0.0 114.032 176.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.1 tt -64.4 -44.77 90.22 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.071 0.851 . . . . 0.0 110.536 175.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 49.7 tp -61.11 -39.04 88.5 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.229 0.612 . . . . 0.0 111.797 175.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -67.21 -36.62 82.1 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 175.256 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 87.5 mt -63.89 -42.55 96.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 123.828 0.851 . . . . 0.0 111.346 171.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 97.7 mt -63.65 -37.2 86.45 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.154 -0.966 . . . . 0.0 112.661 173.143 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 65.2 m170 -61.76 -44.66 96.46 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 118.813 0.733 . . . . 0.0 111.581 169.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.76 -28.72 69.77 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.184 0.994 . . . . 0.0 112.976 177.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.99 -3.81 31.49 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.456 1.102 . . . . 0.0 113.552 172.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.81 12.32 60.74 Favored Glycine 0 CA--C 1.536 1.375 0 C-N-CA 125.177 1.37 . . . . 0.0 115.355 177.17 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -106.93 156.39 18.76 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.011 1.325 . . . . 0.0 112.736 -179.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -80.62 -178.48 6.76 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.684 -0.635 . . . . 0.0 111.07 169.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 176.79 155.01 12.56 Favored Glycine 0 C--N 1.34 0.781 0 N-CA-C 118.497 2.159 . . . . 0.0 118.497 176.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -147.01 -67.71 0.26 Allowed 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 127.227 2.211 . . . . 0.0 108.078 169.18 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 1.5 pmm? -130.09 154.63 47.27 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 126.214 1.806 . . . . 0.0 115.548 176.388 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -154.57 160.81 41.72 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 115.183 1.549 . . . . 0.0 115.183 -168.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 44.6 p -96.42 173.26 7.46 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 127.028 2.131 . . . . 0.0 109.893 167.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.2 t -56.54 -41.94 74.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 CA-C-N 120.785 1.629 . . . . 0.0 110.001 169.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 56.8 tptt -60.27 -43.17 96.43 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.729 1.15 . . . . 0.0 112.386 -179.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -74.12 -36.89 64.23 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 83.3 t -67.85 -50.57 58.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 CA-C-N 118.959 0.799 . . . . 0.0 111.013 172.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.6 ppp? -69.54 -26.52 64.54 Favored 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 114.55 1.315 . . . . 0.0 114.55 -168.572 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -57.77 -54.24 49.08 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.289 0.636 . . . . 0.0 110.826 171.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -74.54 -31.08 62.01 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 176.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -69.43 -39.1 78.06 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 120.61 1.55 . . . . 0.0 112.627 175.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.6 -47.36 89.81 Favored Glycine 0 CA--C 1.53 1.011 0 CA-C-N 118.986 0.812 . . . . 0.0 111.466 172.051 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.0 tp60 -57.62 -43.22 84.61 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.313 1.045 . . . . 0.0 112.356 172.503 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -62.79 -53.8 48.8 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.28 1.432 . . . . 0.0 110.621 177.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 34.7 mt -57.04 -37.36 54.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 124.288 1.035 . . . . 0.0 110.751 177.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 40.3 mmm -70.23 -41.47 73.55 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 114.141 1.163 . . . . 0.0 114.141 176.191 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.8 p -78.48 -26.31 13.92 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 CA-C-N 119.974 1.261 . . . . 0.0 112.99 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 55.5 mmtt -91.77 -14.44 29.87 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.817 1.647 . . . . 0.0 113.253 173.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.8 mp0 52.19 62.3 2.77 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 126.766 2.026 . . . . 0.0 113.673 -176.182 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 45.8 mt -88.37 -5.24 58.42 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 121.576 -0.703 . . . . 0.0 112.749 174.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 46.3 p90 -84.62 157.19 21.25 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.986 1.314 . . . . 0.0 111.703 172.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -87.41 126.83 35.11 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 169.454 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.46 -30.74 61.11 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 179.084 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -94.73 -21.08 18.98 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.712 1.205 . . . . 0.0 112.809 -170.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -140.07 68.44 1.36 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 127.765 2.426 . . . . 0.0 109.056 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -63.35 -16.96 61.99 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 114.05 1.13 . . . . 0.0 114.05 -169.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 32.8 p80 -61.53 -29.89 70.29 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 118.706 -0.664 . . . . 0.0 112.689 169.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 17.9 mtp -87.99 145.5 25.97 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 113.62 0.971 . . . . 0.0 113.62 176.186 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 t -131.0 131.21 64.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 C-N-CA 126.073 1.749 . . . . 0.0 108.743 173.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -112.66 103.57 11.61 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.553 1.541 . . . . 0.0 108.758 174.571 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 15.0 m -103.05 9.69 38.42 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.73 0.812 . . . . 0.0 112.402 176.008 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.75 -27.32 66.35 Favored Glycine 0 CA--C 1.537 1.444 0 C-N-CA 124.999 1.285 . . . . 0.0 114.795 -174.336 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -88.24 2.09 84.94 Favored Glycine 0 CA--C 1.54 1.631 0 C-N-CA 124.988 1.28 . . . . 0.0 115.202 173.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -110.67 177.78 4.57 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.471 1.508 . . . . 0.0 112.727 -175.061 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 80.4 mt -51.73 -35.84 44.79 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.205 1.402 . . . . 0.0 113.201 171.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 94.5 mt -61.2 -47.91 83.97 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 121.624 -0.673 . . . . 0.0 110.933 174.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -67.8 -34.79 83.76 Favored Glycine 0 CA--C 1.532 1.142 0 CA-C-O 119.032 -0.871 . . . . 0.0 113.464 176.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.42 -28.77 63.18 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 119.43 1.615 . . . . 0.0 112.449 176.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 40.8 tp -74.42 -53.61 9.23 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.875 1.27 . . . . 0.0 112.416 173.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -96.82 -17.24 20.34 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.787 1.403 . . . . 0.0 114.787 -169.442 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 80.85 -17.96 10.21 Favored Glycine 0 CA--C 1.539 1.584 0 C-N-CA 125.66 1.6 . . . . 0.0 116.061 -177.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.04 31.13 0.62 Allowed 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 116.362 1.986 . . . . 0.0 116.362 -174.23 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 8.0 mm-40 -69.35 73.17 0.33 Allowed 'General case' 0 N--CA 1.477 0.886 0 O-C-N 121.336 -0.852 . . . . 0.0 112.853 -179.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 12.1 m -134.38 136.43 43.36 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.083 1.353 . . . . 0.0 109.178 169.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 54.5 p90 -160.08 174.06 14.88 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -168.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.8 t -124.59 141.42 52.11 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 124.852 1.261 . . . . 0.0 110.548 169.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 25.9 m -72.0 -12.28 15.73 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 175.21 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 41.4 pttt -77.35 -10.71 59.61 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 113.683 0.994 . . . . 0.0 113.683 172.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -123.48 77.42 54.54 Favored Pre-proline 0 CA--C 1.548 0.866 0 C-N-CA 126.285 1.834 . . . . 0.0 109.642 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -68.83 -28.05 30.44 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 123.389 2.726 . . . . 0.0 114.873 -169.355 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 62.5 m -59.4 -55.14 49.05 Favored Pre-proline 0 N--CA 1.476 0.863 0 CA-C-N 120.172 1.351 . . . . 0.0 114.436 -177.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -65.88 -29.74 49.65 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 122.11 1.873 . . . . 0.0 112.93 176.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 26.5 tp -66.37 -46.48 76.55 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.89 0.876 . . . . 0.0 110.746 174.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -61.83 -39.25 91.14 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 118.557 -0.735 . . . . 0.0 112.638 172.253 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -59.36 -48.9 79.88 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 119.778 1.172 . . . . 0.0 112.599 177.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 41.3 mtm -62.31 -47.91 82.2 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.653 0.781 . . . . 0.0 112.634 173.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 61.7 mt -56.65 -45.26 81.73 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 124.312 1.045 . . . . 0.0 110.978 177.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 24.0 ttt180 -60.42 -21.64 62.47 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 120.052 1.296 . . . . 0.0 114.234 175.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -86.85 -17.5 33.21 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.5 1.52 . . . . 0.0 113.208 172.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 53.9 t30 -104.92 -25.19 12.69 Favored 'General case' 0 CA--C 1.555 1.138 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 176.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 55.1 tp -131.21 133.04 45.11 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 128.739 2.816 . . . . 0.0 108.548 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 62.6 t -73.0 106.88 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 171.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 10.0 t -158.8 -172.83 3.97 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 125.045 1.338 . . . . 0.0 111.776 -174.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 3.0 pp -73.76 177.93 5.16 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.811 2.045 . . . . 0.0 114.41 176.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -124.14 167.66 13.95 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.2 1.8 . . . . 0.0 112.9 -172.441 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 8.8 t . . . . . 0 N--CA 1.48 1.029 0 C-N-CA 123.871 0.869 . . . . 0.0 113.284 175.473 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 200' ' ' 44Z . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 21.7 pt20 . . . . . 0 CA--C 1.544 0.723 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.0 mt -107.45 143.66 17.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 C-N-CA 125.658 1.583 . . . . 0.0 109.38 178.433 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 45.9 t30 -83.95 87.76 7.12 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.057 0.943 . . . . 0.0 110.436 173.188 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -88.53 -179.65 6.1 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 114.271 1.212 . . . . 0.0 114.271 -171.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 23.4 m -114.62 168.35 6.52 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 127.203 2.201 . . . . 0.0 109.675 169.013 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.7 ttp-105 -101.39 129.85 26.04 Favored Pre-proline 0 N--CA 1.481 1.099 0 O-C-N 120.876 -1.14 . . . . 0.0 111.408 178.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -75.24 -177.03 3.22 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.736 2.958 . . . . 0.0 112.121 173.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.5 ttmt -64.06 148.09 50.6 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 121.394 -0.816 . . . . 0.0 110.668 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.9 mt -55.84 -45.85 99.83 Favored Pre-proline 0 N--CA 1.476 0.836 0 N-CA-C 115.225 1.565 . . . . 0.0 115.225 -168.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -64.8 -24.17 61.8 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 CA-C-N 122.219 1.828 . . . . 0.0 113.773 175.096 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 tp -66.68 -40.26 88.49 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.774 1.17 . . . . 0.0 110.919 172.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.9 tt -63.37 -37.91 89.09 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.824 0.85 . . . . 0.0 111.41 171.3 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.1 mmpt? -60.99 -43.21 99.2 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 121.516 -0.74 . . . . 0.0 112.565 171.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 83.3 mt -62.75 -42.38 96.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.994 0.918 . . . . 0.0 111.5 174.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 55.8 mt -63.57 -38.61 91.79 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.473 -0.767 . . . . 0.0 111.671 176.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 17.6 m170 -67.67 -41.05 84.32 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.584 -0.697 . . . . 0.0 111.789 172.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.37 -26.83 68.93 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.182 0.993 . . . . 0.0 113.292 174.043 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.25 -6.78 42.31 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.154 0.982 . . . . 0.0 113.462 171.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 94.75 7.19 60.24 Favored Glycine 0 CA--C 1.536 1.397 0 C-N-CA 125.638 1.59 . . . . 0.0 115.063 -178.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -89.09 170.64 10.46 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 118.931 1.365 . . . . 0.0 112.874 178.189 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 34.4 tp60 -128.14 139.03 52.72 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.607 1.563 . . . . 0.0 109.013 169.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 175.94 150.8 8.28 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 115.275 0.87 . . . . 0.0 115.275 -179.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -125.06 13.39 8.4 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 127.023 2.129 . . . . 0.0 111.641 172.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.2 mtm -174.9 134.44 0.35 Allowed 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 128.916 2.886 . . . . 0.0 109.343 -172.146 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -154.08 143.88 21.78 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.192 0.997 . . . . 0.0 113.145 -174.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 51.4 p -85.75 170.06 12.82 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 121.058 -1.026 . . . . 0.0 111.203 168.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 2.7 t -55.81 -43.92 75.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 O-C-N 120.337 -1.477 . . . . 0.0 110.391 169.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -57.29 -34.69 68.94 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 120.813 -1.179 . . . . 0.0 113.002 177.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -80.43 -45.79 17.04 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 113.183 0.808 . . . . 0.0 113.183 173.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 79.5 t -61.61 -49.1 85.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 123.482 0.713 . . . . 0.0 110.895 -177.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.71 -38.58 83.81 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 123.375 0.67 . . . . 0.0 111.944 -172.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -56.46 -52.45 64.65 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.423 176.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 45.9 m-85 -74.41 -29.93 61.71 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 176.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.4 mp -68.28 -37.91 81.18 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 120.793 1.633 . . . . 0.0 112.215 171.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -61.95 -43.41 99.22 Favored Glycine 0 CA--C 1.531 1.069 0 CA-C-N 119.13 0.877 . . . . 0.0 111.828 171.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.2 tp60 -60.89 -43.09 98.96 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.394 1.077 . . . . 0.0 112.446 171.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -61.35 -51.78 67.37 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.205 1.002 . . . . 0.0 110.58 175.44 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 69.1 mt -59.8 -38.56 76.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 124.54 1.136 . . . . 0.0 110.825 179.095 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.2 tpt -63.63 -47.63 80.56 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.985 1.314 . . . . 0.0 112.509 174.127 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.2 p -78.63 -28.46 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 -175.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 57.5 mmtt -91.97 -15.78 27.48 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.459 1.503 . . . . 0.0 113.522 174.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.4 mp0 55.06 63.6 2.07 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.947 2.099 . . . . 0.0 112.992 -174.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 11.2 tp -88.29 -9.37 53.06 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.003 0.921 . . . . 0.0 112.3 176.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 26.4 p90 -88.58 162.08 16.57 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.134 1.774 . . . . 0.0 110.874 169.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -99.9 129.67 46.01 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 122.029 -0.42 . . . . 0.0 110.72 169.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.2 -20.57 59.29 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 113.934 1.087 . . . . 0.0 113.934 173.847 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -82.94 -31.44 27.7 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.639 1.176 . . . . 0.0 111.347 -178.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -152.33 69.99 0.9 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.262 1.825 . . . . 0.0 111.957 -169.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 27.9 mp0 -56.36 -20.8 20.91 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.233 1.413 . . . . 0.0 113.795 -178.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 30.5 p80 -65.32 -12.82 55.67 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 174.067 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 22.5 tpp -111.61 135.97 51.46 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 126.621 1.968 . . . . 0.0 111.105 172.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 18.9 t -119.7 107.89 22.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 125.713 1.605 . . . . 0.0 108.309 171.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -92.15 110.98 22.37 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.223 0.609 . . . . 0.0 110.672 -177.143 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 84.3 m -103.58 14.84 30.35 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 -170.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.47 120.74 23.6 Favored Glycine 0 CA--C 1.535 1.303 0 O-C-N 121.411 -0.805 . . . . 0.0 111.711 176.235 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 80.0 0.59 85.93 Favored Glycine 0 CA--C 1.54 1.625 0 C-N-CA 124.533 1.063 . . . . 0.0 115.575 -174.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -80.39 158.07 26.11 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.42 1.61 . . . . 0.0 111.496 171.191 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 10.9 mp -46.69 -41.16 14.51 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.312 1.445 . . . . 0.0 112.336 169.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 98.6 mt -57.52 -43.39 84.26 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.028 0.931 . . . . 0.0 111.703 174.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -72.64 -36.74 58.26 Favored Glycine 0 CA--C 1.53 0.981 0 CA-C-O 118.499 -1.167 . . . . 0.0 113.42 178.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -62.56 -42.55 99.61 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 120.318 2.059 . . . . 0.0 110.425 173.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 30.9 tp -65.34 -50.44 65.62 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.314 1.046 . . . . 0.0 113.191 -179.139 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -95.06 -7.64 38.98 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 124.782 1.233 . . . . 0.0 112.611 -175.363 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 82.47 -28.05 3.54 Favored Glycine 0 CA--C 1.541 1.662 0 C-N-CA 125.795 1.664 . . . . 0.0 113.167 -169.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.48 136.51 6.4 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 129.01 2.924 . . . . 0.0 109.265 176.544 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -139.32 22.96 2.55 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 119.267 0.939 . . . . 0.0 112.218 177.512 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 14.7 m -84.78 129.59 34.8 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 179.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 5.1 p90 -159.29 171.26 20.15 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.854 -1.066 . . . . 0.0 112.251 -168.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 79.9 p -113.39 136.26 52.96 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 114.659 -1.155 . . . . 0.0 113.434 177.122 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 3.7 m -77.65 -9.86 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 N-CA-C 114.066 1.136 . . . . 0.0 114.066 -177.243 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -80.91 -8.73 59.81 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.859 1.664 . . . . 0.0 115.149 174.227 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 39.0 t0 -131.29 90.11 39.24 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 125.519 1.527 . . . . 0.0 111.197 -172.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -67.46 -27.39 39.76 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 123.595 2.863 . . . . 0.0 115.08 -174.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 66.0 m -61.11 -53.16 66.21 Favored Pre-proline 0 N--CA 1.476 0.872 0 N-CA-C 114.326 1.232 . . . . 0.0 114.326 -177.562 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -66.6 -31.64 40.5 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 122.364 2.043 . . . . 0.0 112.761 175.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 6.5 tp -60.98 -49.02 79.12 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.779 1.232 . . . . 0.0 111.093 173.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -59.03 -29.26 67.15 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 -176.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -68.78 -51.52 40.14 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.604 1.093 . . . . 0.0 111.822 177.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 3.4 ptt? -68.86 -29.52 67.84 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.021 0.928 . . . . 0.0 112.633 178.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 17.7 tp -76.15 -47.13 25.44 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 126.821 2.049 . . . . 0.0 111.44 179.409 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 74.5 mtt180 -57.34 -27.47 62.27 Favored 'General case' 0 N--CA 1.485 1.282 0 CA-C-N 120.379 1.445 . . . . 0.0 113.16 176.08 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 90.4 mttt -76.49 -24.02 53.79 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.511 1.525 . . . . 0.0 113.509 174.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 60.2 m-20 -112.64 -22.23 10.86 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -177.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.6 tt -136.58 125.17 23.68 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 127.701 2.4 . . . . 0.0 108.265 -173.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 59.8 t -69.39 110.46 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 O-C-N 121.589 -0.694 . . . . 0.0 110.045 -179.394 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 12.4 t -148.91 165.62 31.02 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.964 1.706 . . . . 0.0 110.794 178.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -75.02 165.29 25.49 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 114.969 1.47 . . . . 0.0 114.969 -173.019 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -129.64 16.55 5.88 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 126.331 1.853 . . . . 0.0 114.59 -169.057 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 8.4 t . . . . . 0 N--CA 1.478 0.966 0 C-N-CA 125.585 1.554 . . . . 0.0 112.842 -176.552 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 200' ' ' 44Z . . . . . 0.422 ' CG1' ' CD3' ' A' ' 200' ' ' 44Z . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 . . . . . 0 CA--C 1.54 0.577 0 CA-C-O 121.914 0.864 . . . . 0.0 112.302 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 34.5 pt -94.95 1.04 10.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 C-N-CA 126.966 2.106 . . . . 0.0 115.519 -169.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 60.8 t30 55.39 13.88 1.0 Allowed 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 127.178 2.191 . . . . 0.0 115.39 -176.432 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.9 mm100 -112.98 167.74 10.27 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.704 2.001 . . . . 0.0 113.726 -172.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 24.1 m -134.53 172.5 16.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.984 0 C-N-CA 127.843 2.457 . . . . 0.0 110.869 -170.216 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 -79.7 144.55 60.72 Favored Pre-proline 0 N--CA 1.483 1.201 0 O-C-N 121.125 -0.984 . . . . 0.0 110.934 -172.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -73.12 176.71 8.75 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 123.542 2.828 . . . . 0.0 112.291 176.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -58.22 146.81 32.52 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.873 0.869 . . . . 0.0 110.054 173.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.1 mp -56.5 -46.41 99.82 Favored Pre-proline 0 N--CA 1.476 0.864 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -169.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -66.75 -25.27 46.4 Favored 'Trans proline' 0 C--N 1.351 0.687 0 CA-C-N 121.513 1.576 . . . . 0.0 113.706 176.007 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.1 tt -69.73 -40.84 75.97 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.235 0.925 . . . . 0.0 109.972 173.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 28.6 tp -59.6 -36.92 77.24 Favored 'General case' 0 CA--C 1.547 0.846 0 O-C-N 120.954 -1.091 . . . . 0.0 111.421 169.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 19.7 mmtp -67.1 -33.72 76.08 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 173.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 83.4 mt -62.29 -38.99 82.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 124.439 1.096 . . . . 0.0 111.728 170.687 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.7 mp -68.95 -37.22 78.73 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 120.076 1.307 . . . . 0.0 112.356 171.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 58.7 m170 -60.87 -43.55 98.26 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 119.22 0.918 . . . . 0.0 111.697 172.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.66 -23.44 67.26 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.939 1.296 . . . . 0.0 113.416 175.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.08 -6.7 44.33 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 123.711 0.804 . . . . 0.0 113.089 171.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.73 19.38 40.82 Favored Glycine 0 CA--C 1.536 1.351 0 C-N-CA 125.142 1.353 . . . . 0.0 114.712 178.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -126.24 145.27 50.47 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.868 1.267 . . . . 0.0 113.133 -175.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -74.5 153.6 39.05 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.915 0.886 . . . . 0.0 110.177 169.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -150.76 134.92 4.94 Favored Glycine 0 CA--C 1.529 0.922 0 N-CA-C 115.601 1.0 . . . . 0.0 115.601 179.479 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -148.88 78.57 1.4 Allowed 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 127.168 2.187 . . . . 0.0 108.847 173.592 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . 0.435 0.0 OUTLIER 64.87 141.01 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 129.536 3.134 . . . . 0.0 117.838 176.072 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -161.8 171.56 17.6 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 114.055 1.131 . . . . 0.0 114.055 -168.735 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 37.7 p -96.47 174.23 6.96 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 127.109 2.163 . . . . 0.0 112.523 169.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 15.9 t -50.19 -46.12 24.6 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 O-C-N 121.173 -0.954 . . . . 0.0 111.545 171.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -57.37 -38.51 74.33 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.752 0.821 . . . . 0.0 112.639 -176.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -80.51 -34.95 35.26 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.42 1.088 . . . . 0.0 112.948 176.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 73.2 t -72.79 -45.88 55.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 O-C-N 121.215 -0.928 . . . . 0.0 112.291 -179.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.419 ' SD ' ' CD2' ' A' ' 200' ' ' 44Z . 22.3 mmt -64.59 -30.66 71.68 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-N 120.012 1.278 . . . . 0.0 112.643 -178.303 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 85.4 t60 -53.85 -53.75 48.18 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.431 173.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -74.61 -34.27 62.79 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 174.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -70.29 -43.72 69.82 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.775 1.17 . . . . 0.0 112.814 -179.411 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.98 -39.68 98.37 Favored Glycine 0 CA--C 1.531 1.084 0 CA-C-N 118.843 0.747 . . . . 0.0 111.873 173.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.2 tp60 -61.18 -48.09 83.16 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.667 1.187 . . . . 0.0 111.934 172.146 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -60.7 -50.07 74.95 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.811 0.844 . . . . 0.0 110.885 177.29 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 60.4 mt -61.76 -35.76 69.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 124.817 1.247 . . . . 0.0 111.26 179.006 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.2 tpt -65.53 -39.52 91.87 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.595 1.158 . . . . 0.0 112.514 171.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 84.3 t -78.32 -32.97 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 CA-C-N 119.336 0.971 . . . . 0.0 112.969 -179.065 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 47.8 mmtt -90.46 -15.53 30.68 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.021 1.329 . . . . 0.0 113.15 177.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.3 mp0 50.17 66.45 1.14 Allowed 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 127.295 2.238 . . . . 0.0 113.183 -173.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 51.5 mt -91.2 0.64 57.49 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.52 0.728 . . . . 0.0 112.901 177.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 54.4 p90 -89.3 157.49 18.18 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.945 1.298 . . . . 0.0 111.354 171.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -88.52 134.58 33.82 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 121.86 -0.525 . . . . 0.0 110.69 169.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.47 -21.34 65.39 Favored 'General case' 0 CA--C 1.544 0.727 0 O-C-N 120.893 -1.129 . . . . 0.0 113.689 172.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -82.69 -34.57 27.32 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.704 1.202 . . . . 0.0 111.101 -179.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -147.89 76.35 1.38 Allowed 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 128.035 2.534 . . . . 0.0 109.43 -169.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 26.3 mp0 -59.34 -23.56 62.61 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.299 -0.876 . . . . 0.0 113.003 -178.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 3.3 p-80 -66.12 -23.22 66.45 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 171.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 12.6 tpp -87.06 132.05 33.93 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.758 1.223 . . . . 0.0 110.092 170.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.7 t -124.41 112.09 30.99 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 C-N-CA 126.577 1.951 . . . . 0.0 108.968 -175.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 58.0 t80 -89.98 59.26 4.47 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.411 1.485 . . . . 0.0 111.468 -176.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 52.5 m -72.28 -4.51 30.06 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 120.832 -1.168 . . . . 0.0 113.021 171.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.3 -24.65 59.27 Favored Glycine 0 CA--C 1.541 1.682 0 CA-C-N 120.648 1.567 . . . . 0.0 113.819 169.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -91.1 6.54 81.5 Favored Glycine 0 CA--C 1.542 1.778 0 C-N-CA 125.528 1.537 . . . . 0.0 115.326 171.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -112.13 171.1 7.71 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.249 1.82 . . . . 0.0 112.494 -173.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.1 mp -47.16 -40.23 15.37 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.244 1.418 . . . . 0.0 111.969 169.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.1 tp -64.76 -32.22 73.81 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.879 0.872 . . . . 0.0 111.945 175.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -75.11 -35.09 50.38 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 126.515 2.007 . . . . 0.0 114.458 174.331 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -65.63 -42.62 91.29 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 119.791 1.796 . . . . 0.0 110.232 169.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 25.6 tp -60.59 -49.33 77.96 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.155 1.382 . . . . 0.0 112.588 179.29 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.34 -11.09 21.52 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 115.478 1.658 . . . . 0.0 115.478 -177.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.11 -18.81 8.95 Favored Glycine 0 CA--C 1.539 1.59 0 C-N-CA 125.843 1.687 . . . . 0.0 115.968 179.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.33 28.64 0.57 Allowed 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 115.018 1.488 . . . . 0.0 115.018 -175.617 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -70.66 46.34 0.09 Allowed 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 116.212 1.93 . . . . 0.0 116.212 -168.21 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 41.0 m -105.93 142.41 35.68 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 120.789 -1.194 . . . . 0.0 110.491 170.155 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . 0.406 ' CD1' ' HE1' ' A' ' 101' ' ' MET . 52.7 p90 -161.39 171.4 18.31 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 -168.126 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 3.5 m -121.92 136.26 54.92 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.247 1.019 . . . . 0.0 111.389 174.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 22.4 m -74.22 -21.65 17.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 C-N-CA 124.214 1.005 . . . . 0.0 113.707 -175.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -72.72 -8.58 56.06 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 125.335 1.454 . . . . 0.0 114.375 174.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 47.0 t0 -117.64 82.78 16.47 Favored Pre-proline 0 CA--C 1.547 0.851 0 C-N-CA 126.786 2.034 . . . . 0.0 109.097 -179.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -66.57 -31.9 40.25 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 123.478 2.785 . . . . 0.0 114.591 -169.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 55.7 m -56.7 -54.19 56.53 Favored Pre-proline 0 N--CA 1.476 0.856 0 CA-C-N 120.057 1.299 . . . . 0.0 113.949 -176.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -66.2 -28.52 47.98 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 122.071 1.847 . . . . 0.0 113.209 175.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 32.4 tp -69.61 -43.47 72.68 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.145 -0.972 . . . . 0.0 111.255 176.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -65.92 -34.3 77.8 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 121.496 -0.753 . . . . 0.0 112.329 171.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -63.08 -46.74 86.01 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.348 0.976 . . . . 0.0 112.578 175.006 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.406 ' HE1' ' CD1' ' A' ' 90' ' ' PHE . 47.7 mtm -60.2 -49.92 75.73 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.244 0.618 . . . . 0.0 111.656 170.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 49.6 mt -59.92 -45.52 92.31 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-O 118.023 -0.989 . . . . 0.0 111.648 -176.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -55.09 -25.81 33.8 Favored 'General case' 0 N--CA 1.48 1.038 0 CA-C-N 119.926 1.239 . . . . 0.0 114.139 175.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -94.22 -16.77 23.34 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 125.322 1.449 . . . . 0.0 114.782 174.318 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 24.9 m-80 -117.95 -41.86 2.87 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-N 119.418 1.008 . . . . 0.0 113.598 -171.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 39.5 tp -102.78 95.94 6.52 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.614 1.966 . . . . 0.0 107.971 169.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 21.8 t -61.18 135.11 26.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-O 121.419 0.628 . . . . 0.0 110.941 -171.057 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 9.1 t -146.42 -172.73 4.02 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 126.358 1.863 . . . . 0.0 111.024 -170.391 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -83.06 25.83 0.66 Allowed 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.341 1.856 . . . . 0.0 114.385 -170.279 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -150.95 146.67 26.41 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.672 1.989 . . . . 0.0 111.268 -178.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 9.7 t . . . . . 0 N--CA 1.484 1.226 0 C-N-CA 126.897 2.079 . . . . 0.0 114.471 -176.829 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 200' ' ' 44Z . . . . . 0.419 ' CD2' ' SD ' ' A' ' 53' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 . . . . . 0 CA--C 1.544 0.739 0 CA-C-O 120.952 0.406 . . . . 0.0 111.703 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 34.4 mm -70.82 132.82 32.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 124.154 0.982 . . . . 0.0 111.073 178.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -131.0 17.38 5.09 Favored 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 126.398 1.879 . . . . 0.0 111.888 170.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -85.71 -179.41 6.85 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.858 2.063 . . . . 0.0 112.644 -178.187 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.1 m -103.68 172.05 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 126.302 1.841 . . . . 0.0 111.181 -178.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 42.8 ttp180 -110.42 134.98 20.68 Favored Pre-proline 0 N--CA 1.479 0.987 0 C-N-CA 124.195 0.998 . . . . 0.0 112.914 -169.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.01 159.2 54.08 Favored 'Trans proline' 0 CA--C 1.537 0.637 0 C-N-CA 122.367 2.044 . . . . 0.0 111.788 169.575 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -55.55 161.19 2.12 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 115.027 1.492 . . . . 0.0 115.027 177.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 22.2 mt -61.15 -41.72 82.26 Favored Pre-proline 0 CA--C 1.548 0.881 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 -168.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -70.08 -30.76 20.28 Favored 'Trans proline' 0 C--N 1.355 0.871 0 C-N-CA 122.152 1.901 . . . . 0.0 112.763 169.557 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 tt -71.95 -43.87 64.5 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.795 1.238 . . . . 0.0 110.841 -175.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 23.8 tp -53.65 -37.28 62.97 Favored 'General case' 0 CA--C 1.548 0.899 0 O-C-N 120.98 -1.075 . . . . 0.0 111.801 171.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -72.41 -19.18 61.64 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.198 0.999 . . . . 0.0 113.695 177.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 84.7 mt -69.49 -41.72 80.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 CA-C-N 118.988 0.813 . . . . 0.0 109.074 168.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.4 mp -66.73 -35.92 81.25 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 121.564 -0.71 . . . . 0.0 110.913 175.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 50.6 m170 -60.85 -49.51 77.17 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 118.362 0.528 . . . . 0.0 111.535 169.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.18 -23.85 67.62 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.525 1.13 . . . . 0.0 113.903 177.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.43 -14.83 63.28 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.402 1.081 . . . . 0.0 113.066 173.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.74 22.52 10.98 Favored Glycine 0 CA--C 1.537 1.415 0 C-N-CA 125.26 1.41 . . . . 0.0 114.557 179.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -132.42 154.9 49.38 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.83 1.252 . . . . 0.0 113.581 -174.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.9 tt0 -77.39 152.35 34.42 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.718 0.807 . . . . 0.0 110.128 169.534 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -144.73 126.17 2.58 Favored Glycine 0 N--CA 1.469 0.88 0 N-CA-C 114.88 0.712 . . . . 0.0 114.88 178.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -151.06 78.35 1.29 Allowed 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 126.748 2.019 . . . . 0.0 108.931 173.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 30.7 mtm 67.18 140.86 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 129.668 3.187 . . . . 0.0 117.112 174.189 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -170.41 166.03 8.58 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.983 1.313 . . . . 0.0 113.489 -169.506 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 66.9 p -74.04 167.69 21.01 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 125.188 1.395 . . . . 0.0 111.497 168.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -59.63 -39.07 78.55 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.387 0 O-C-N 120.5 -1.375 . . . . 0.0 111.904 174.029 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -62.28 -44.04 97.44 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.716 1.606 . . . . 0.0 112.876 176.146 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -67.84 -37.46 81.91 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 121.908 -0.495 . . . . 0.0 111.857 172.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 33.3 t -61.5 -43.91 97.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 123.617 0.767 . . . . 0.0 111.317 173.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 19.4 ptp -73.08 -23.93 60.6 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 115.579 1.696 . . . . 0.0 115.579 -178.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 84.5 t60 -51.72 -44.04 63.07 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 118.73 0.695 . . . . 0.0 110.321 168.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 -74.79 -44.0 51.79 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 170.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.6 mp -67.25 -34.42 77.39 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 120.32 1.418 . . . . 0.0 113.873 -177.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.45 -47.37 87.98 Favored Glycine 0 CA--C 1.531 1.091 0 CA-C-N 119.222 0.919 . . . . 0.0 111.572 171.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 11.2 tp60 -54.93 -46.14 74.89 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.596 1.158 . . . . 0.0 111.604 171.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -62.55 -51.37 67.65 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.656 0.782 . . . . 0.0 110.828 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 67.8 mt -61.67 -37.24 77.51 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 123.758 0.823 . . . . 0.0 111.034 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 35.4 mmt -67.38 -42.45 83.36 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 174.043 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 6.6 p -78.54 -28.75 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 CA-C-N 119.869 1.213 . . . . 0.0 113.386 -177.246 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 57.4 mmtt -92.2 -15.83 27.04 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.905 1.282 . . . . 0.0 113.446 174.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 14.1 mp0 53.12 67.19 1.04 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.213 1.805 . . . . 0.0 113.06 -174.243 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.7 tp -90.31 3.83 52.51 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.34 1.056 . . . . 0.0 112.376 179.641 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 40.0 p90 -109.16 160.59 15.96 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 128.183 2.593 . . . . 0.0 110.725 178.194 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -94.54 130.71 40.84 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 109.273 -0.639 . . . . 0.0 109.273 168.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -57.03 -33.81 67.58 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 119.11 0.868 . . . . 0.0 112.737 -175.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -87.07 -15.13 39.48 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.873 0.869 . . . . 0.0 112.343 -172.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -141.97 57.47 1.48 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 127.875 2.47 . . . . 0.0 110.512 -176.303 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -60.31 -17.46 42.94 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 121.381 -0.824 . . . . 0.0 112.728 178.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 6.1 p-80 -63.42 -5.38 3.57 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.272 1.429 . . . . 0.0 114.332 169.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 48.1 mtp -128.35 150.75 49.96 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.97 1.259 . . . . 0.0 112.844 169.047 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 t -127.29 140.55 48.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 126.314 1.846 . . . . 0.0 108.243 175.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 86.1 m-85 -120.68 68.23 0.86 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.1 0.96 . . . . 0.0 112.622 -168.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 1.9 m -84.81 13.5 5.78 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 -170.269 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.82 -28.63 63.47 Favored Glycine 0 CA--C 1.541 1.705 0 O-C-N 120.473 -1.392 . . . . 0.0 114.663 178.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -94.15 5.95 72.04 Favored Glycine 0 CA--C 1.541 1.697 0 C-N-CA 125.358 1.456 . . . . 0.0 115.059 172.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -97.81 175.59 6.11 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.914 1.686 . . . . 0.0 112.53 -175.055 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 10.5 mp -59.56 -36.32 75.97 Favored 'General case' 0 CA--C 1.547 0.828 0 O-C-N 121.022 -1.048 . . . . 0.0 111.451 169.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 80.5 mt -57.64 -41.54 81.61 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.173 -0.954 . . . . 0.0 111.384 169.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -69.63 -35.3 74.11 Favored Glycine 0 CA--C 1.533 1.169 0 CA-C-O 118.709 -1.05 . . . . 0.0 113.821 176.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -72.94 -29.45 63.11 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 120.333 2.067 . . . . 0.0 111.477 176.398 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 29.2 tp -70.79 -50.47 35.4 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.104 1.362 . . . . 0.0 112.449 174.011 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.58 -6.4 23.9 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 124.628 1.171 . . . . 0.0 113.969 -171.182 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.47 -28.88 2.31 Favored Glycine 0 CA--C 1.54 1.647 0 C-N-CA 125.571 1.558 . . . . 0.0 113.759 -171.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.89 135.05 11.18 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 128.134 2.574 . . . . 0.0 110.005 176.85 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -148.54 42.75 0.99 Allowed 'General case' 0 N--CA 1.476 0.857 0 CA-C-O 122.283 1.039 . . . . 0.0 110.373 179.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 14.8 m -93.54 136.34 33.91 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 121.5 -0.75 . . . . 0.0 110.268 170.122 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 53.8 p90 -158.85 167.52 29.22 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.293 1.037 . . . . 0.0 113.497 -169.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 9.7 t -103.7 136.51 43.27 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.57 1.148 . . . . 0.0 111.468 170.29 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 5.5 m -77.83 -11.7 13.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 N-CA-C 114.859 1.429 . . . . 0.0 114.859 178.235 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 18.8 pttm -84.06 -8.53 59.09 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 115.26 1.578 . . . . 0.0 115.26 -176.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 42.2 t0 -120.58 96.22 48.93 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 126.148 1.779 . . . . 0.0 111.132 -169.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -60.37 -30.89 91.93 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 124.095 3.197 . . . . 0.0 115.315 -178.428 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 69.3 m -60.44 -55.02 49.24 Favored Pre-proline 0 N--CA 1.477 0.905 0 CA-C-N 120.264 1.393 . . . . 0.0 113.913 -177.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -67.1 -27.76 41.66 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 122.064 1.842 . . . . 0.0 112.795 175.182 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 46.4 mt -61.45 -53.95 49.84 Favored 'General case' 0 C--N 1.344 0.341 0 CA-C-N 119.155 0.889 . . . . 0.0 110.535 173.184 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -58.94 -39.38 81.46 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.122 0.873 . . . . 0.0 113.012 176.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -58.67 -49.19 78.48 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 118.763 0.71 . . . . 0.0 112.572 177.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 45.2 mtm -68.14 -47.38 68.25 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.249 0.62 . . . . 0.0 112.317 175.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 69.4 mt -54.52 -47.98 72.48 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.229 1.012 . . . . 0.0 111.034 -178.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -59.56 -22.07 61.2 Favored 'General case' 0 N--CA 1.482 1.165 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 175.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -88.42 -22.05 23.94 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 125.977 1.711 . . . . 0.0 113.727 173.559 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -111.26 -33.72 6.36 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -170.59 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 42.7 tp -97.7 119.01 35.5 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.957 2.103 . . . . 0.0 108.938 169.137 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 21.4 t -68.84 132.71 32.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 176.57 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 5.2 t -149.65 -177.7 6.03 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.11 0.964 . . . . 0.0 112.426 -174.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -87.17 28.73 0.9 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.496 1.918 . . . . 0.0 114.385 -169.495 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -143.29 159.34 42.52 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.103 1.761 . . . . 0.0 112.836 -172.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 62.6 p . . . . . 0 N--CA 1.484 1.243 0 C-N-CA 127.274 2.229 . . . . 0.0 114.291 177.076 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 200' ' ' 44Z . . . . . 0.459 ' CG1' ' CD3' ' A' ' 200' ' ' 44Z . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 31.1 m . . . . . 0 N--CA 1.483 1.181 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 42.7 mtm180 -86.83 143.14 34.99 Favored Pre-proline 0 N--CA 1.48 1.055 0 O-C-N 121.304 -0.873 . . . . 0.0 111.862 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -81.48 -179.28 4.82 Favored 'Trans proline' 0 CA--C 1.535 0.529 0 C-N-CA 124.371 3.381 . . . . 0.0 112.447 173.711 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.9 ttmt -70.38 149.68 47.05 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.034 0.534 . . . . 0.0 109.932 175.061 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 85.4 mt -62.44 -41.76 75.8 Favored Pre-proline 0 N--CA 1.478 0.933 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 -168.634 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -63.33 -29.81 72.76 Favored 'Trans proline' 0 C--N 1.349 0.582 0 CA-C-N 121.58 1.6 . . . . 0.0 114.001 171.202 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 7.9 tp -64.68 -42.01 95.66 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 119.591 1.087 . . . . 0.0 110.549 172.11 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.1 tt -64.34 -35.09 79.73 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.012 0.925 . . . . 0.0 111.792 174.833 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -66.3 -41.39 89.83 Favored 'General case' 0 N--CA 1.483 1.219 0 O-C-N 120.954 -1.091 . . . . 0.0 113.089 170.159 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 74.5 mt -62.46 -39.0 82.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 CA-C-N 119.413 1.006 . . . . 0.0 111.179 173.325 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 52.4 mt -65.3 -42.12 93.4 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.083 0.953 . . . . 0.0 111.919 173.538 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 34.4 m170 -61.56 -41.13 96.93 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.15 -0.969 . . . . 0.0 112.172 171.626 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.54 -27.52 69.02 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.89 0.876 . . . . 0.0 112.964 176.075 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.449 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -74.66 -3.55 31.98 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.303 1.041 . . . . 0.0 113.515 172.157 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 92.28 6.83 64.3 Favored Glycine 0 CA--C 1.537 1.449 0 C-N-CA 125.542 1.544 . . . . 0.0 114.821 -178.438 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -85.49 168.34 14.63 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 118.745 1.272 . . . . 0.0 113.327 179.558 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 22.2 tm0? -135.36 140.89 45.39 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.712 1.605 . . . . 0.0 108.157 168.901 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 175.03 172.93 40.39 Favored Glycine 0 CA--C 1.526 0.73 0 N-CA-C 115.512 0.965 . . . . 0.0 115.512 -176.611 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -133.23 -58.25 0.9 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 126.227 1.811 . . . . 0.0 109.889 173.356 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 21.5 mtm -95.62 137.26 34.93 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.049 1.739 . . . . 0.0 111.568 175.493 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 84.6 m-85 -150.45 138.4 20.08 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.719 1.208 . . . . 0.0 112.532 -178.248 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 51.1 p -81.94 169.57 16.63 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.164 0.986 . . . . 0.0 110.477 168.172 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -56.39 -36.59 47.51 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 O-C-N 120.459 -1.401 . . . . 0.0 111.434 172.752 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 54.9 tptt -68.03 -44.79 75.68 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.726 1.211 . . . . 0.0 112.56 176.787 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 58.5 mt-10 -66.1 -36.81 84.16 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.206 0.602 . . . . 0.0 112.014 176.308 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 66.8 t -61.87 -50.37 80.43 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 C-N-CA 123.25 0.62 . . . . 0.0 110.409 170.198 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.35 -39.16 93.78 Favored 'General case' 0 C--N 1.334 -0.094 0 C-N-CA 126.261 1.824 . . . . 0.0 114.279 -172.338 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 83.1 t60 -51.59 -52.57 46.44 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 122.732 0.413 . . . . 0.0 111.309 174.361 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -74.79 -32.68 62.07 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 115.103 1.519 . . . . 0.0 115.103 174.379 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -70.25 -40.68 74.28 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 120.779 1.627 . . . . 0.0 112.89 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -60.62 -47.35 91.59 Favored Glycine 0 CA--C 1.53 0.978 0 N-CA-C 110.914 -0.875 . . . . 0.0 110.914 171.701 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 11.6 tp60 -57.17 -42.37 80.98 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.296 1.038 . . . . 0.0 112.503 173.22 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.449 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 71.3 t80 -63.96 -51.54 63.87 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.817 1.247 . . . . 0.0 110.784 178.648 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 37.1 mt -61.66 -37.74 78.69 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 C-N-CA 123.869 0.868 . . . . 0.0 110.793 178.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 34.9 mmt -66.73 -43.16 84.93 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 174.047 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 7.4 p -78.49 -28.6 14.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 CA-C-N 119.894 1.225 . . . . 0.0 113.386 -176.894 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 20.2 mmtp -91.13 -15.81 28.81 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.052 1.341 . . . . 0.0 113.458 173.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 14.6 mp0 54.18 63.34 2.21 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.078 1.751 . . . . 0.0 112.707 -174.788 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 13.6 tp -92.3 12.59 21.97 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.047 1.339 . . . . 0.0 111.961 -178.706 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 32.9 p90 -123.02 160.68 25.8 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 128.482 2.713 . . . . 0.0 110.625 -177.115 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.2 t0 -92.82 128.61 38.75 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 169.392 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.27 -30.95 52.4 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 179.709 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -94.11 -16.41 23.8 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.004 1.322 . . . . 0.0 112.559 -172.866 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -139.57 59.46 1.59 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 127.43 2.292 . . . . 0.0 109.83 -177.663 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -63.23 -17.75 62.79 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.526 0.73 . . . . 0.0 111.961 -178.546 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 6.4 p-80 -63.91 -1.39 1.41 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.353 1.461 . . . . 0.0 113.429 168.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 36.3 mtp -128.03 145.43 50.99 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 120.293 1.406 . . . . 0.0 111.618 168.209 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.7 t -127.36 140.26 49.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 125.484 1.514 . . . . 0.0 108.208 173.417 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 -112.74 52.61 0.77 Allowed 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.378 1.071 . . . . 0.0 113.818 -168.511 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 32.6 m -70.5 1.73 4.78 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -176.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.57 -25.45 55.36 Favored Glycine 0 CA--C 1.541 1.69 0 CA-C-N 120.558 1.527 . . . . 0.0 114.185 169.834 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -89.26 5.87 83.86 Favored Glycine 0 CA--C 1.542 1.727 0 C-N-CA 125.375 1.464 . . . . 0.0 115.327 171.647 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -109.46 172.36 6.9 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.335 1.854 . . . . 0.0 112.058 -174.558 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 88.5 mt -55.02 -35.62 64.62 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 120.986 -1.071 . . . . 0.0 112.352 169.35 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.1 tp -60.46 -42.58 96.49 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.738 0.815 . . . . 0.0 111.116 174.311 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -65.92 -44.36 91.95 Favored Glycine 0 CA--C 1.529 0.937 0 C-N-CA 125.378 1.466 . . . . 0.0 113.627 172.17 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.2 -26.91 65.96 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.376 1.588 . . . . 0.0 112.356 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 28.2 tp -71.83 -54.56 9.77 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.036 1.334 . . . . 0.0 111.996 169.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -88.64 -5.15 58.34 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-N 118.771 0.714 . . . . 0.0 112.71 -170.613 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 78.69 -27.89 2.17 Favored Glycine 0 CA--C 1.54 1.605 0 C-N-CA 126.131 1.824 . . . . 0.0 113.291 -170.045 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.81 134.85 9.0 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 128.28 2.632 . . . . 0.0 109.741 176.317 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -145.17 28.39 1.22 Allowed 'General case' 0 N--CA 1.476 0.863 0 O-C-N 121.3 -0.875 . . . . 0.0 110.876 174.726 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 14.9 m -87.92 135.61 33.33 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 121.59 -0.694 . . . . 0.0 109.387 170.631 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 17.5 p90 -158.26 168.75 26.18 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 123.84 0.856 . . . . 0.0 113.215 -169.255 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 14.9 t -110.26 136.19 49.84 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 122.373 1.082 . . . . 0.0 112.217 170.5 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -78.09 -13.66 13.93 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-N 114.08 -1.418 . . . . 0.0 114.115 -171.321 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 47.5 pttt -81.26 -7.31 59.55 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 125.867 1.667 . . . . 0.0 115.034 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -119.36 85.22 30.66 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 126.07 1.748 . . . . 0.0 110.828 -172.438 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.25 -27.32 56.15 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.953 3.102 . . . . 0.0 115.261 -172.122 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 68.2 m -63.59 -55.89 30.8 Favored Pre-proline 0 N--CA 1.478 0.928 0 CA-C-N 119.924 1.238 . . . . 0.0 114.036 -177.463 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -66.81 -29.55 42.01 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 121.872 1.715 . . . . 0.0 112.341 175.407 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 25.4 tp -65.48 -43.05 91.46 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.069 0.948 . . . . 0.0 111.583 176.699 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -60.49 -39.56 88.14 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 121.702 -0.624 . . . . 0.0 111.968 173.252 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -61.68 -43.28 99.16 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.244 0.618 . . . . 0.0 112.521 176.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 38.2 mtm -64.04 -49.83 70.84 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 173.059 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 65.7 mt -53.25 -48.16 68.46 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.886 1.274 . . . . 0.0 110.855 177.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.64 -18.51 12.38 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.745 1.618 . . . . 0.0 114.881 176.371 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -96.9 -22.51 16.84 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 125.955 1.702 . . . . 0.0 114.0 172.362 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -105.28 -26.98 11.79 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 119.818 1.19 . . . . 0.0 113.808 -175.703 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 3.0 tt . . . . . 0 CA--C 1.54 0.575 0 C-N-CA 125.817 1.647 . . . . 0.0 106.937 169.062 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 23.6 m . . . . . 0 N--CA 1.478 0.954 0 CA-C-O 121.025 0.441 . . . . 0.0 111.778 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 30.8 ttt180 -101.31 123.24 45.41 Favored Pre-proline 0 N--CA 1.476 0.848 0 C-N-CA 124.651 1.181 . . . . 0.0 110.503 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.0 162.31 40.48 Favored 'Trans proline' 0 CA--C 1.535 0.553 0 C-N-CA 123.061 2.507 . . . . 0.0 113.197 170.414 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.3 tpmt? -61.38 150.42 35.3 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.476 1.11 . . . . 0.0 110.121 175.617 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 88.3 mt -60.73 -41.6 83.36 Favored Pre-proline 0 N--CA 1.478 0.936 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -170.28 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -65.09 -26.7 57.68 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 121.952 1.768 . . . . 0.0 114.02 172.686 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.2 tt -72.49 -45.91 57.24 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.06 0.944 . . . . 0.0 109.988 172.508 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.3 tt -57.79 -33.57 68.69 Favored 'General case' 0 N--CA 1.477 0.919 0 O-C-N 120.782 -1.199 . . . . 0.0 112.237 173.452 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.75 -28.14 69.76 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 113.742 1.015 . . . . 0.0 113.742 170.935 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 68.8 mt -67.33 -45.93 84.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 CA-C-N 119.74 1.155 . . . . 0.0 110.319 171.526 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.03 -40.66 90.08 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.275 0.63 . . . . 0.0 111.015 176.142 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.8 m170 -64.99 -42.74 94.25 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.758 -0.589 . . . . 0.0 112.51 173.024 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.34 -28.97 70.07 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.15 -0.969 . . . . 0.0 112.983 176.5 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.442 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -73.46 -6.08 44.1 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.428 1.091 . . . . 0.0 113.308 172.886 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.66 7.58 64.67 Favored Glycine 0 CA--C 1.537 1.464 0 C-N-CA 125.374 1.464 . . . . 0.0 115.129 -179.528 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -88.21 167.58 13.47 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 118.752 1.276 . . . . 0.0 112.745 177.128 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.8 tm0? -126.71 141.78 51.74 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.286 1.434 . . . . 0.0 109.551 169.831 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 174.92 167.5 34.29 Favored Glycine 0 N--CA 1.465 0.629 0 N-CA-C 114.726 0.65 . . . . 0.0 114.726 -178.73 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -126.8 -59.68 1.26 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.57 1.548 . . . . 0.0 109.734 170.016 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.0 mpp? -93.72 139.98 30.19 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 126.079 1.752 . . . . 0.0 111.126 170.436 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -146.53 138.97 25.08 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.425 1.49 . . . . 0.0 111.506 178.083 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 41.1 p -74.25 170.52 15.41 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 121.274 -0.891 . . . . 0.0 110.911 168.473 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.9 t -55.43 -40.53 58.39 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 120.349 -1.469 . . . . 0.0 110.891 169.361 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -66.96 -43.63 82.63 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.314 1.046 . . . . 0.0 112.695 179.212 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 64.6 mt-10 -69.79 -33.48 72.44 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 176.821 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 52.2 t -61.93 -54.87 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 CA-C-N 118.663 0.665 . . . . 0.0 109.49 169.53 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.3 ttm -61.75 -37.26 83.6 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 126.941 2.096 . . . . 0.0 114.586 -173.388 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -51.7 -55.19 21.01 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.154 0.582 . . . . 0.0 111.827 172.706 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 60.0 m-85 -74.82 -30.0 61.25 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 174.338 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -71.67 -39.65 70.15 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 120.277 1.399 . . . . 0.0 112.677 -179.649 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.16 -39.87 98.21 Favored Glycine 0 CA--C 1.533 1.202 0 CA-C-N 119.395 0.998 . . . . 0.0 111.959 171.633 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 9.9 tp60 -64.57 -45.74 85.78 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.023 1.329 . . . . 0.0 112.215 172.784 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.442 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 57.2 t80 -61.35 -49.54 76.55 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 124.21 1.004 . . . . 0.0 109.901 178.125 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 56.7 mt -64.38 -33.63 64.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 C-N-CA 124.322 1.049 . . . . 0.0 111.032 178.248 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 5.5 tpt -63.46 -39.23 93.9 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 120.23 1.377 . . . . 0.0 112.127 169.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 99.3 t -78.17 -41.53 26.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 O-C-N 120.429 -1.419 . . . . 0.0 112.584 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 52.7 mmtt -85.97 -15.71 40.66 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.082 1.353 . . . . 0.0 112.654 -176.713 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 48.02 81.29 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 128.558 2.743 . . . . 0.0 114.307 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 37.0 mt -101.86 8.71 41.17 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 125.194 1.398 . . . . 0.0 113.381 -177.794 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 50.3 p90 -122.58 164.02 18.94 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.325 1.85 . . . . 0.0 111.456 -175.752 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -91.32 133.46 35.41 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.79 -0.569 . . . . 0.0 111.369 174.232 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.2 -20.92 60.85 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 120.902 -1.124 . . . . 0.0 113.902 173.873 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -81.79 -32.03 31.53 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.543 1.137 . . . . 0.0 111.157 179.635 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -146.2 74.4 1.37 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 127.604 2.361 . . . . 0.0 110.311 -169.529 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 29.1 mp0 -60.41 -23.9 64.73 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 120.859 -1.151 . . . . 0.0 112.58 178.126 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 5.6 p-80 -67.4 -6.91 21.28 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.385 1.474 . . . . 0.0 114.502 171.065 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 1.9 tpt -111.98 126.77 55.5 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 126.749 2.02 . . . . 0.0 109.726 173.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.4 t -126.07 133.77 68.1 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.766 1.227 . . . . 0.0 110.062 -178.113 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -118.51 100.12 7.25 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.929 1.692 . . . . 0.0 109.086 173.018 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 61.4 m -99.43 14.51 29.51 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.509 0.724 . . . . 0.0 112.737 175.204 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.19 -27.25 68.77 Favored Glycine 0 CA--C 1.538 1.527 0 O-C-N 120.639 -1.288 . . . . 0.0 114.518 -177.656 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -90.03 4.61 83.17 Favored Glycine 0 CA--C 1.54 1.639 0 C-N-CA 125.145 1.355 . . . . 0.0 114.995 172.095 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -106.89 172.01 7.05 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.772 1.629 . . . . 0.0 112.669 -174.269 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 10.9 mp -53.45 -34.12 56.68 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.396 1.478 . . . . 0.0 112.663 169.838 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 98.7 mt -61.08 -47.15 87.67 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 121.111 -0.993 . . . . 0.0 111.654 170.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -63.3 -38.6 96.7 Favored Glycine 0 CA--C 1.533 1.171 0 CA-C-O 119.16 -0.8 . . . . 0.0 112.889 173.247 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.65 -29.66 62.47 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 119.715 1.758 . . . . 0.0 112.973 -179.497 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.1 pp -81.4 -34.72 31.45 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 175.431 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -100.4 -9.68 21.96 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 119.17 0.895 . . . . 0.0 113.15 -177.404 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.49 -27.1 3.33 Favored Glycine 0 CA--C 1.54 1.634 0 C-N-CA 125.525 1.536 . . . . 0.0 112.905 -169.298 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.68 138.36 6.05 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 128.032 2.533 . . . . 0.0 111.282 178.512 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -144.21 69.2 1.27 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.836 0.854 . . . . 0.0 109.149 168.873 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -105.02 124.88 50.3 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 169.421 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 49.8 p90 -157.22 156.03 31.85 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.18 0.992 . . . . 0.0 112.118 -169.32 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 10.5 m -107.65 135.8 48.48 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.076 171.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . 0.264 0.2 OUTLIER -78.23 -14.5 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 -169.412 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -75.5 -7.9 55.33 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 125.562 1.545 . . . . 0.0 114.832 174.309 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -116.67 95.35 45.97 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 126.719 2.008 . . . . 0.0 110.334 -172.708 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -62.45 -28.36 77.91 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.965 3.11 . . . . 0.0 115.249 -178.039 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 67.3 m -58.85 -53.89 61.84 Favored Pre-proline 0 N--CA 1.477 0.885 0 CA-C-N 120.121 1.328 . . . . 0.0 113.834 -178.576 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -65.52 -28.31 53.56 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 122.099 1.866 . . . . 0.0 113.187 174.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 49.4 mt -62.92 -50.89 69.07 Favored 'General case' 0 C--N 1.344 0.356 0 CA-C-N 119.6 1.091 . . . . 0.0 111.13 174.009 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -60.48 -40.84 92.76 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 118.883 -0.579 . . . . 0.0 112.146 174.759 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -61.46 -49.65 75.97 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 119.229 0.922 . . . . 0.0 112.845 179.173 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 31.4 mtm -60.78 -49.64 76.67 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.657 0.783 . . . . 0.0 112.211 175.504 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 10.2 mp -65.97 -42.38 89.96 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 118.542 -0.742 . . . . 0.0 111.814 -176.433 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -57.28 -20.27 27.0 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 119.835 1.198 . . . . 0.0 113.842 172.302 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 90.4 mttt -95.84 -13.87 23.68 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.77 1.628 . . . . 0.0 114.404 174.764 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 8.1 p-10 -124.8 -16.33 6.21 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 116.154 1.909 . . . . 0.0 116.154 -178.049 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 57.4 tp . . . . . 0 CA--C 1.537 0.451 0 C-N-CA 127.358 2.263 . . . . 0.0 108.858 176.434 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 32.6 m . . . . . 0 N--CA 1.483 1.198 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 24.0 ttp-105 -99.49 134.47 21.15 Favored Pre-proline 0 N--CA 1.481 1.111 0 O-C-N 120.847 -1.158 . . . . 0.0 111.802 178.692 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -71.46 171.29 16.51 Favored 'Trans proline' 0 C--N 1.354 0.832 0 C-N-CA 123.624 2.883 . . . . 0.0 112.65 175.437 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.6 tpmt? -62.01 146.66 49.52 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.251 1.02 . . . . 0.0 110.739 178.271 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 90.2 mt -55.3 -49.22 93.64 Favored Pre-proline 0 N--CA 1.474 0.769 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 -173.742 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -65.11 -21.09 63.22 Favored 'Trans proline' 0 CA--C 1.54 0.807 0 CA-C-N 122.034 1.762 . . . . 0.0 113.856 177.599 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.2 tt -75.72 -46.36 31.52 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.247 0.93 . . . . 0.0 109.657 169.472 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.1 tp -57.01 -34.62 68.36 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.246 -0.909 . . . . 0.0 113.285 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -64.3 -22.4 66.94 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 121.271 -0.893 . . . . 0.0 113.34 175.195 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 51.7 mt -70.23 -39.67 77.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 123.93 0.892 . . . . 0.0 110.363 171.595 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.9 mp -70.01 -35.37 74.31 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.347 -0.846 . . . . 0.0 111.279 175.375 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 57.7 m170 -61.03 -46.32 91.23 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 118.208 0.458 . . . . 0.0 111.263 169.619 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.65 -24.68 67.89 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 175.443 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.415 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -71.58 -6.31 39.81 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 172.054 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.72 17.59 47.98 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 125.039 1.304 . . . . 0.0 115.069 177.493 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -121.13 150.01 41.91 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.043 1.337 . . . . 0.0 112.71 -179.08 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -74.46 171.12 14.34 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.486 0.714 . . . . 0.0 111.548 169.655 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -169.06 133.1 2.74 Favored Glycine 0 C--N 1.341 0.817 0 N-CA-C 117.487 1.755 . . . . 0.0 117.487 -178.329 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -140.56 -13.41 0.99 Allowed 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 173.678 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 3.2 mtm -171.04 134.08 0.92 Allowed 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 126.539 1.936 . . . . 0.0 111.391 -175.337 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -155.1 147.5 24.0 Favored 'General case' 0 CA--C 1.55 0.974 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 -173.094 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 50.7 p -94.97 171.84 8.51 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 127.106 2.162 . . . . 0.0 110.371 168.234 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -52.09 -48.02 42.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 CA-C-N 120.356 1.435 . . . . 0.0 110.428 169.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -53.32 -37.84 62.65 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.114 0.966 . . . . 0.0 113.091 -179.46 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -80.82 -42.98 20.75 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.248 1.019 . . . . 0.0 112.726 176.088 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 75.6 t -64.18 -48.32 86.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 O-C-N 120.851 -1.156 . . . . 0.0 111.775 -179.384 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.4 mmm -72.66 -25.8 61.4 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 118.906 0.775 . . . . 0.0 112.421 -174.79 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 77.1 t60 -60.56 -54.52 44.44 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.678 0.791 . . . . 0.0 110.804 169.575 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 53.6 m-85 -72.37 -32.62 66.58 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 113.58 0.955 . . . . 0.0 113.58 179.404 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.9 mp -69.91 -40.64 75.48 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.882 1.219 . . . . 0.0 112.197 172.316 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.22 -42.91 99.72 Favored Glycine 0 CA--C 1.529 0.959 0 CA-C-N 118.979 0.809 . . . . 0.0 111.847 172.88 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.8 tp-100 -58.52 -47.03 85.51 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.554 1.141 . . . . 0.0 111.973 171.824 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.415 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 28.3 t80 -60.7 -49.59 76.9 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.323 0.649 . . . . 0.0 110.752 175.799 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 54.6 mt -57.68 -37.83 61.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 124.868 1.267 . . . . 0.0 111.125 177.428 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -69.24 -37.56 78.05 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.876 0.87 . . . . 0.0 113.136 174.933 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 81.4 t -78.23 -31.5 16.34 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 124.179 0.992 . . . . 0.0 112.524 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 54.3 mmtt -92.34 -14.72 28.32 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.894 1.278 . . . . 0.0 113.152 176.909 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.7 mp0 53.61 61.16 3.24 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.467 1.907 . . . . 0.0 113.134 -172.911 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.4 mp -95.69 6.16 49.62 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.003 1.321 . . . . 0.0 113.539 -179.728 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 52.4 p90 -89.88 158.95 17.2 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.823 1.649 . . . . 0.0 110.691 169.603 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -85.27 123.37 30.67 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.589 -0.694 . . . . 0.0 110.904 170.581 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.4 -22.07 66.74 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 120.895 -1.128 . . . . 0.0 112.865 178.61 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 48.2 mm-40 -78.7 -26.94 44.92 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.357 -0.839 . . . . 0.0 111.035 -176.596 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -160.25 83.71 0.71 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 127.189 2.196 . . . . 0.0 110.906 -171.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -60.58 -14.24 18.96 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.626 1.57 . . . . 0.0 115.089 -169.752 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 22.6 p80 -65.31 -23.44 67.02 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 118.112 -0.947 . . . . 0.0 113.082 171.601 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 42.3 mmm -83.88 139.91 32.32 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 119.67 1.123 . . . . 0.0 112.843 173.424 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 60.4 t -120.86 133.45 67.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 127.794 2.437 . . . . 0.0 107.0 169.73 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 10.5 t80 -121.38 13.34 11.04 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 116.833 2.161 . . . . 0.0 116.833 -168.391 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 15.9 p 39.06 31.33 0.05 OUTLIER 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 128.407 2.683 . . . . 0.0 117.542 175.418 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.34 108.34 1.89 Allowed Glycine 0 CA--C 1.534 1.269 0 O-C-N 120.897 -1.127 . . . . 0.0 113.348 -171.737 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 68.45 14.06 66.29 Favored Glycine 0 CA--C 1.54 1.62 0 C-N-CA 124.21 0.91 . . . . 0.0 114.895 -175.37 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -75.45 155.27 36.45 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 118.682 1.241 . . . . 0.0 112.265 -177.186 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 81.8 mt -62.53 -32.5 73.46 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.412 1.485 . . . . 0.0 111.56 169.31 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 84.8 mt -54.81 -48.04 73.3 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.7 0.8 . . . . 0.0 111.354 171.73 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -71.78 -38.76 60.66 Favored Glycine 0 CA--C 1.53 0.976 0 C-N-CA 124.42 1.009 . . . . 0.0 112.989 178.032 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.93 -26.62 65.17 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 119.673 1.736 . . . . 0.0 112.481 177.457 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 47.7 tp -76.12 -56.32 4.76 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.397 1.479 . . . . 0.0 112.181 173.297 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.31 -7.73 41.01 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 113.469 0.915 . . . . 0.0 113.469 -169.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 80.66 -25.64 3.34 Favored Glycine 0 CA--C 1.539 1.558 0 C-N-CA 125.756 1.646 . . . . 0.0 113.34 -169.675 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.6 137.2 11.03 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 126.801 2.041 . . . . 0.0 112.058 178.264 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -148.14 49.06 1.05 Allowed 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.686 1.195 . . . . 0.0 110.429 168.653 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 8.1 p -89.85 137.53 32.26 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 121.327 -0.858 . . . . 0.0 110.063 169.155 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 46.6 p90 -171.82 167.95 6.2 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.519 0.728 . . . . 0.0 112.064 -169.151 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 60.2 p -121.21 143.83 48.93 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.071 -0.968 . . . . 0.0 113.51 173.131 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 27.1 m -74.39 -12.86 15.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 -179.218 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.39 -0.48 46.2 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.778 1.631 . . . . 0.0 114.586 170.5 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 40.8 t0 -126.85 77.39 74.65 Favored Pre-proline 0 CA--C 1.551 1.015 0 C-N-CA 127.135 2.174 . . . . 0.0 109.95 171.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_exo -56.64 -40.88 81.33 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 124.623 3.549 . . . . 0.0 114.882 -175.531 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 55.6 m -52.92 -54.86 39.24 Favored Pre-proline 0 N--CA 1.476 0.848 0 N-CA-C 114.838 1.421 . . . . 0.0 114.838 -172.388 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -65.81 -30.46 49.62 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 122.336 2.024 . . . . 0.0 113.425 175.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.45 ' HA ' ' HE2' ' A' ' 101' ' ' MET . 37.0 tp -66.95 -47.28 72.13 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.003 0.921 . . . . 0.0 110.672 176.103 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -58.23 -40.53 81.93 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.721 0.808 . . . . 0.0 112.228 171.341 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -60.11 -51.04 71.31 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 119.729 1.15 . . . . 0.0 112.902 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.45 ' HE2' ' HA ' ' A' ' 98' ' ' LEU . 64.7 mtm -63.6 -44.5 93.8 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.034 0.534 . . . . 0.0 112.116 175.968 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 66.4 mt -61.5 -46.74 88.73 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-O 117.732 -1.128 . . . . 0.0 111.326 178.573 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 42.1 ttt180 -56.37 -24.98 47.9 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 121.265 1.848 . . . . 0.0 113.547 174.851 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -85.17 -17.9 35.77 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.561 1.544 . . . . 0.0 114.012 174.79 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -123.36 -6.39 8.22 Favored 'General case' 0 CA--C 1.558 1.273 0 N-CA-C 115.698 1.74 . . . . 0.0 115.698 178.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 68.8 tp . . . . . 0 CA--C 1.541 0.597 0 C-N-CA 128.512 2.725 . . . . 0.0 109.679 -174.079 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 33.7 m . . . . . 0 N--CA 1.48 1.074 0 N-CA-C 111.656 0.243 . . . . 0.0 111.656 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.3 ttp-105 -95.42 133.66 25.55 Favored Pre-proline 0 N--CA 1.48 1.037 0 O-C-N 120.991 -1.068 . . . . 0.0 111.522 172.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -68.38 171.44 12.88 Favored 'Trans proline' 0 C--N 1.354 0.857 0 C-N-CA 123.799 3.0 . . . . 0.0 113.501 176.05 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.5 ttmt -62.86 149.62 43.9 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.142 0.977 . . . . 0.0 110.685 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 81.3 mt -61.66 -43.11 87.12 Favored Pre-proline 0 N--CA 1.476 0.866 0 N-CA-C 115.062 1.504 . . . . 0.0 115.062 -168.536 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -65.0 -28.41 57.66 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.035 1.824 . . . . 0.0 113.752 172.268 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 5.1 tt -67.49 -49.19 64.63 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 119.221 0.919 . . . . 0.0 109.499 172.449 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 13.9 tp -60.24 -33.07 71.77 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 121.294 -0.879 . . . . 0.0 112.784 177.41 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -58.66 -27.69 65.02 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 174.048 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 60.0 mt -72.99 -39.13 57.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.17 0.988 . . . . 0.0 110.998 175.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.3 mp -68.08 -34.85 77.19 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.477 -0.764 . . . . 0.0 110.953 174.132 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 60.4 m170 -61.94 -44.58 96.47 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 121.998 -0.439 . . . . 0.0 111.513 169.556 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -65.02 -26.99 68.51 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 175.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.33 -3.41 26.97 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.352 1.061 . . . . 0.0 113.435 171.67 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.67 15.26 57.02 Favored Glycine 0 CA--C 1.535 1.317 0 C-N-CA 125.021 1.296 . . . . 0.0 115.309 174.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -117.13 145.34 43.86 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.943 1.297 . . . . 0.0 112.551 -179.114 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -75.06 170.69 15.51 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.255 0.622 . . . . 0.0 111.329 169.461 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -173.0 143.74 7.44 Favored Glycine 0 C--N 1.34 0.765 0 N-CA-C 117.324 1.69 . . . . 0.0 117.324 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -140.7 -11.22 1.02 Allowed 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 175.519 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.5 mtm -169.68 130.18 1.03 Allowed 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 125.744 1.618 . . . . 0.0 111.579 -175.479 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -155.82 139.5 16.06 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -175.56 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 64.8 p -80.77 176.02 10.17 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.792 0.837 . . . . 0.0 109.646 166.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -59.34 -37.64 70.41 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.324 0 O-C-N 120.262 -1.524 . . . . 0.0 111.651 172.381 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -66.97 -42.19 85.57 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.865 1.666 . . . . 0.0 113.059 175.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -70.34 -35.06 73.36 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.776 -0.577 . . . . 0.0 112.094 174.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 18.7 t -60.38 -48.91 86.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 124.085 0.954 . . . . 0.0 110.844 169.875 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -62.34 -36.43 82.16 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 127.097 2.159 . . . . 0.0 114.178 -173.176 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -51.7 -53.02 43.74 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 122.857 0.463 . . . . 0.0 111.956 170.499 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -74.7 -31.66 61.94 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 114.296 1.221 . . . . 0.0 114.296 175.684 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -72.14 -41.93 66.58 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.971 1.26 . . . . 0.0 112.876 -179.324 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -60.46 -42.94 99.22 Favored Glycine 0 CA--C 1.532 1.126 0 CA-C-N 118.826 0.739 . . . . 0.0 111.559 171.261 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.2 tp60 -61.61 -42.26 98.63 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.77 1.228 . . . . 0.0 112.648 173.287 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -64.45 -51.88 60.83 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.307 1.043 . . . . 0.0 110.42 177.838 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 55.8 mt -60.85 -37.4 76.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 O-C-N 121.501 -0.749 . . . . 0.0 110.597 179.324 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.2 tpt -63.88 -46.57 84.33 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.88 1.272 . . . . 0.0 112.892 173.59 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.3 p -78.5 -27.24 14.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 CA-C-N 119.73 1.15 . . . . 0.0 113.683 -176.417 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 55.0 mmtt -90.48 -15.72 30.27 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 125.074 1.349 . . . . 0.0 113.365 173.212 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.4 mp0 54.35 60.08 3.79 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 127.034 2.134 . . . . 0.0 113.105 -174.192 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.9 tp -95.62 6.18 49.6 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.08 0.952 . . . . 0.0 113.301 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 47.4 p90 -95.68 159.8 14.81 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 126.109 1.763 . . . . 0.0 111.022 173.476 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -86.07 129.24 34.9 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.518 -0.739 . . . . 0.0 111.836 172.483 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.35 -24.26 66.48 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 120.799 -1.188 . . . . 0.0 112.752 176.536 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 49.7 mm-40 -78.68 -30.57 46.23 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.28 -0.887 . . . . 0.0 110.756 -176.966 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -151.72 80.58 1.28 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 128.036 2.534 . . . . 0.0 110.159 -169.863 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 27.2 mp0 -60.76 -15.54 30.67 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 114.292 1.219 . . . . 0.0 114.292 -174.494 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 21.6 p80 -64.31 -22.51 66.98 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 118.402 -0.809 . . . . 0.0 113.113 171.548 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.8 ttm -96.88 137.27 36.23 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 119.838 1.199 . . . . 0.0 112.783 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 52.7 t -132.06 138.32 52.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 126.419 1.888 . . . . 0.0 110.18 -179.342 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -104.16 51.02 0.78 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.934 1.293 . . . . 0.0 113.889 -171.007 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 90.4 m -69.39 -1.61 8.82 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 115.321 1.6 . . . . 0.0 115.321 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.36 -25.19 60.1 Favored Glycine 0 CA--C 1.539 1.578 0 CA-C-N 120.462 1.483 . . . . 0.0 113.686 169.525 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -91.57 9.96 75.84 Favored Glycine 0 CA--C 1.54 1.653 0 C-N-CA 125.506 1.526 . . . . 0.0 115.064 170.673 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -119.6 174.83 6.17 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.539 1.536 . . . . 0.0 112.689 -173.95 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -49.84 -40.17 41.32 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.004 1.722 . . . . 0.0 111.933 176.474 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 63.1 mt -62.56 -38.12 88.83 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 120.746 0.307 . . . . 0.0 111.155 178.145 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -79.12 -29.09 52.16 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 125.381 1.467 . . . . 0.0 113.593 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -67.47 -42.23 83.33 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 120.491 2.145 . . . . 0.0 109.606 169.255 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 24.1 tp -60.66 -48.46 81.69 Favored 'General case' 0 CA--C 1.552 1.023 0 CA-C-N 114.974 -1.012 . . . . 0.0 112.76 177.32 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 8.1 mt -94.17 -7.39 42.42 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 116.044 1.868 . . . . 0.0 116.044 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.81 -16.33 11.93 Favored Glycine 0 CA--C 1.543 1.836 0 O-C-N 120.701 -1.249 . . . . 0.0 113.797 -169.655 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.23 155.35 26.88 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 129.024 2.93 . . . . 0.0 109.322 173.89 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -164.03 25.57 0.07 Allowed 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 119.229 0.922 . . . . 0.0 112.215 169.294 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 17.2 m -84.97 132.01 34.41 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 120.999 -1.063 . . . . 0.0 108.681 175.425 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 6.3 p90 -161.26 178.57 9.11 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 -167.442 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 96.7 p -122.88 137.67 54.87 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 114.423 -1.262 . . . . 0.0 113.314 173.72 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 15.3 m -73.74 -17.05 17.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 -173.399 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.7 pttt -82.53 -6.31 59.25 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.039 1.736 . . . . 0.0 115.046 -177.699 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -118.73 83.33 22.1 Favored Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 126.119 1.768 . . . . 0.0 110.585 -173.738 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.28 -30.69 54.1 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 124.083 3.189 . . . . 0.0 115.315 -169.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 66.9 m -61.72 -53.96 55.95 Favored Pre-proline 0 N--CA 1.475 0.817 0 CA-C-N 119.698 1.136 . . . . 0.0 113.995 -176.53 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -69.37 -28.38 27.18 Favored 'Trans proline' 0 C--N 1.354 0.818 0 C-N-CA 121.869 1.713 . . . . 0.0 112.764 175.109 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 18.7 tp -66.77 -44.51 81.19 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.884 1.274 . . . . 0.0 111.914 179.263 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -55.48 -39.09 69.98 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.8 1.24 . . . . 0.0 112.947 176.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -59.7 -47.18 86.67 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.717 0.807 . . . . 0.0 112.396 177.393 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 16.7 mtm -69.21 -41.85 76.54 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 178.192 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 65.9 mt -55.34 -54.96 37.06 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.441 1.096 . . . . 0.0 110.588 175.175 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 72.7 ttt180 -52.44 -31.97 37.17 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.247 1.419 . . . . 0.0 113.223 178.097 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -78.78 -29.57 45.1 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.272 1.429 . . . . 0.0 113.757 176.824 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 31.3 m-20 -109.74 -19.16 13.26 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -171.795 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 47.7 tp . . . . . 0 CA--C 1.535 0.4 0 C-N-CA 126.218 1.807 . . . . 0.0 106.436 168.42 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.4 m . . . . . 0 N--CA 1.483 1.175 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.1 ttp-105 -87.59 138.53 31.69 Favored Pre-proline 0 N--CA 1.481 1.094 0 C-N-CA 125.175 1.39 . . . . 0.0 111.814 178.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -73.89 177.75 7.73 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 123.959 3.106 . . . . 0.0 113.71 175.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 32.1 ttmt -69.86 155.21 40.9 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.456 1.102 . . . . 0.0 111.296 179.691 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 68.4 mt -56.25 -45.71 99.88 Favored Pre-proline 0 CA--C 1.544 0.726 0 N-CA-C 116.346 1.98 . . . . 0.0 116.346 -168.174 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -64.19 -29.46 64.62 Favored 'Trans proline' 0 C--N 1.351 0.693 0 CA-C-N 122.152 1.804 . . . . 0.0 113.262 175.142 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.3 tt -71.27 -42.53 68.64 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.068 0.849 . . . . 0.0 110.14 176.009 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 11.5 tp -58.57 -37.15 75.14 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.514 -0.741 . . . . 0.0 111.408 170.093 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.7 -37.09 85.5 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.146 0.979 . . . . 0.0 113.432 175.262 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 87.8 mt -62.57 -44.53 99.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 CA-C-N 119.043 0.838 . . . . 0.0 110.973 170.486 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 71.2 mt -62.39 -37.54 86.15 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.529 0.732 . . . . 0.0 111.857 175.408 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -63.43 -45.28 91.66 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 121.195 -0.941 . . . . 0.0 112.368 169.535 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.62 -27.06 68.97 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.017 0.927 . . . . 0.0 113.085 177.368 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.463 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -71.49 -7.29 46.57 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.352 1.061 . . . . 0.0 113.447 173.03 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 93.18 8.6 61.33 Favored Glycine 0 CA--C 1.537 1.447 0 C-N-CA 125.537 1.541 . . . . 0.0 114.952 -178.608 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -97.62 173.94 6.89 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.891 1.276 . . . . 0.0 113.062 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 15.5 tp60 -129.51 149.19 51.39 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 126.511 1.924 . . . . 0.0 108.92 169.407 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLY . . . . . 0.404 ' HA3' ' CZ ' ' A' ' 47' ' ' PHE . . . -158.68 148.92 18.73 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 116.421 1.328 . . . . 0.0 116.421 -174.053 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -133.41 -14.77 2.54 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.973 1.309 . . . . 0.0 113.829 174.252 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 6.0 mtm -175.41 137.18 0.37 Allowed 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 129.231 3.012 . . . . 0.0 109.367 -178.416 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.404 ' CZ ' ' HA3' ' A' ' 44' ' ' GLY . 0.0 OUTLIER -158.54 170.21 22.7 Favored 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 114.317 1.228 . . . . 0.0 114.317 174.062 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 70.5 p -90.44 171.62 9.3 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 126.295 1.838 . . . . 0.0 112.131 173.422 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.8 t -51.56 -44.08 33.19 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 123.634 0.774 . . . . 0.0 110.761 169.722 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -67.69 -42.86 81.4 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 125.155 1.382 . . . . 0.0 112.89 -179.186 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -72.52 -32.68 66.32 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 118.433 0.56 . . . . 0.0 112.469 179.09 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 43.7 t -63.87 -49.28 82.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 123.459 0.703 . . . . 0.0 109.703 169.155 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -65.22 -34.0 77.33 Favored 'General case' 0 N--CA 1.458 -0.072 0 C-N-CA 126.871 2.069 . . . . 0.0 114.301 -176.3 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -51.56 -52.9 43.38 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.543 0.737 . . . . 0.0 111.257 172.261 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -74.78 -32.83 62.15 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.896 1.443 . . . . 0.0 114.896 172.065 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.67 -41.41 75.54 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 120.674 1.579 . . . . 0.0 113.053 -178.507 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.27 -39.75 98.21 Favored Glycine 0 CA--C 1.533 1.178 0 CA-C-N 118.678 0.672 . . . . 0.0 111.817 173.093 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.5 tp60 -62.8 -45.33 93.16 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.786 1.234 . . . . 0.0 112.045 172.538 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.463 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 60.2 t80 -60.76 -49.71 76.41 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.896 0.879 . . . . 0.0 110.426 177.176 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 53.3 mt -62.21 -34.98 66.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 C-N-CA 124.019 0.928 . . . . 0.0 111.236 177.778 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.76 -38.61 91.58 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 119.575 1.08 . . . . 0.0 112.358 172.102 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 96.5 t -78.28 -34.76 18.88 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 C-N-CA 124.334 1.053 . . . . 0.0 112.998 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 19.0 mmtp -90.16 -14.94 32.51 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.961 1.304 . . . . 0.0 113.328 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.2 mp0 47.34 62.2 2.53 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 127.269 2.228 . . . . 0.0 113.876 -172.536 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 31.6 mt -82.66 -13.11 57.03 Favored 'General case' 0 N--CA 1.478 0.974 0 O-C-N 121.306 -0.871 . . . . 0.0 112.548 175.384 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 44.5 p90 -78.69 152.47 31.59 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.045 0.938 . . . . 0.0 111.744 176.12 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -83.41 127.2 33.49 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 121.834 -0.541 . . . . 0.0 110.619 169.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -65.8 -24.47 66.92 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.1 -1.0 . . . . 0.0 113.515 -176.654 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -85.5 -30.08 23.73 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-O 121.385 0.612 . . . . 0.0 111.337 -171.117 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -148.54 87.82 1.6 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 128.587 2.755 . . . . 0.0 110.064 178.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 29.2 mp0 -61.2 -14.24 24.03 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 -172.019 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 23.9 p80 -61.74 -30.76 70.99 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 118.278 -0.868 . . . . 0.0 112.378 170.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 21.5 tpp -83.07 128.53 34.57 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 119.781 1.173 . . . . 0.0 111.036 177.336 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 3.3 t -120.91 122.49 67.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 C-N-CA 126.106 1.762 . . . . 0.0 108.857 174.584 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -107.49 107.09 17.79 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.509 1.524 . . . . 0.0 109.796 178.134 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 84.2 m -99.8 20.04 14.91 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.253 1.021 . . . . 0.0 113.27 -177.014 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.69 122.98 31.85 Favored Glycine 0 CA--C 1.534 1.264 0 O-C-N 120.937 -1.102 . . . . 0.0 111.872 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 78.27 0.4 77.52 Favored Glycine 0 CA--C 1.54 1.65 0 C-N-CA 124.488 1.042 . . . . 0.0 115.374 -174.182 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -80.72 162.77 23.97 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 119.278 1.539 . . . . 0.0 111.657 171.557 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -46.47 -40.81 12.99 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.623 1.569 . . . . 0.0 111.743 170.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 97.1 mt -60.18 -43.66 95.68 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.088 0.955 . . . . 0.0 111.998 176.593 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -71.49 -34.15 63.62 Favored Glycine 0 CA--C 1.533 1.19 0 C-N-CA 124.99 1.281 . . . . 0.0 114.061 176.438 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -66.85 -42.64 85.4 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 120.637 2.219 . . . . 0.0 110.487 174.061 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 27.1 tp -61.51 -52.65 63.59 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 115.085 -0.961 . . . . 0.0 112.456 177.594 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -101.91 -6.8 23.06 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -169.568 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.86 -29.22 2.41 Favored Glycine 0 CA--C 1.54 1.651 0 O-C-N 120.349 -1.469 . . . . 0.0 112.805 -169.356 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.84 135.86 7.65 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 127.633 2.373 . . . . 0.0 111.926 179.012 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 11.6 mt-30 -142.38 45.84 1.62 Allowed 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.29 1.036 . . . . 0.0 109.831 168.749 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 1.6 m -86.33 128.41 34.92 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 121.161 -0.962 . . . . 0.0 109.184 169.532 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 17.8 p90 -158.02 168.63 26.59 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.496 0.718 . . . . 0.0 112.856 -169.84 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 34.6 t -118.61 138.04 52.85 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.828 170.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -77.53 -1.43 3.86 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 12.6 pttp -84.29 -7.81 59.22 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.565 1.146 . . . . 0.0 113.702 169.566 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -122.89 83.25 49.92 Favored Pre-proline 0 CA--C 1.55 0.981 0 C-N-CA 126.487 1.915 . . . . 0.0 110.819 -170.639 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -67.46 -27.88 39.28 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.88 3.054 . . . . 0.0 115.269 -170.876 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 59.6 m -61.79 -53.71 57.97 Favored Pre-proline 0 N--CA 1.477 0.902 0 CA-C-N 119.867 1.212 . . . . 0.0 114.192 -177.213 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -67.21 -29.98 38.35 Favored 'Trans proline' 0 C--N 1.353 0.777 0 C-N-CA 121.93 1.753 . . . . 0.0 112.636 175.225 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 27.9 tp -65.35 -44.14 88.64 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.408 1.083 . . . . 0.0 111.551 177.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 25.7 t80 -60.43 -36.39 78.07 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.865 1.266 . . . . 0.0 112.195 174.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -65.47 -47.17 77.03 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.664 0.785 . . . . 0.0 112.712 175.267 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 31.1 mtm -57.59 -49.66 75.68 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.024 0.53 . . . . 0.0 111.768 174.177 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 7.5 mp -63.11 -47.89 80.86 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-O 117.294 -1.336 . . . . 0.0 111.125 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 61.7 mtp180 -52.0 -29.65 21.73 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-N 121.067 1.758 . . . . 0.0 113.757 175.468 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -85.82 -20.21 29.5 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.594 1.557 . . . . 0.0 114.879 177.255 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -126.69 -25.64 3.36 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 115.29 1.589 . . . . 0.0 115.29 -174.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 44.7 tp . . . . . 0 CA--C 1.54 0.56 0 C-N-CA 127.619 2.368 . . . . 0.0 107.179 170.862 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 34.8 m . . . . . 0 N--CA 1.484 1.241 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.4 ptt-85 -94.29 156.98 38.25 Favored Pre-proline 0 N--CA 1.488 1.425 0 C-N-CA 124.65 1.18 . . . . 0.0 112.015 169.485 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -68.06 176.43 5.41 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 123.839 3.026 . . . . 0.0 112.756 169.627 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 24.4 ttmt -65.11 148.06 52.35 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.136 0.974 . . . . 0.0 111.2 179.268 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 81.8 mt -53.4 -50.74 81.15 Favored Pre-proline 0 N--CA 1.477 0.914 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -169.122 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -64.43 -22.07 65.96 Favored 'Trans proline' 0 CA--C 1.54 0.777 0 C-N-CA 122.262 1.975 . . . . 0.0 114.142 175.447 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.1 tt -77.9 -37.51 47.81 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 119.825 1.193 . . . . 0.0 110.54 169.719 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 16.2 tp -58.58 -35.09 71.86 Favored 'General case' 0 N--CA 1.475 0.775 0 O-C-N 120.765 -1.209 . . . . 0.0 112.264 171.405 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.439 ' HA ' ' HE2' ' A' ' 35' ' ' LYS . 9.0 mmpt? -59.84 -26.62 65.96 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 172.131 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 81.8 mt -73.04 -36.98 52.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 123.977 0.911 . . . . 0.0 110.662 176.023 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.4 mp -70.51 -34.3 72.17 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.152 -0.967 . . . . 0.0 111.279 172.492 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 43.6 m170 -63.15 -42.44 99.44 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.796 -0.565 . . . . 0.0 111.532 169.904 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.79 -28.54 69.94 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.153 0.981 . . . . 0.0 113.166 173.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.453 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -70.54 -6.51 36.87 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 124.153 0.981 . . . . 0.0 113.33 171.75 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 92.47 16.54 49.14 Favored Glycine 0 CA--C 1.535 1.344 0 C-N-CA 125.309 1.433 . . . . 0.0 115.142 177.394 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -123.76 139.99 53.43 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 118.77 1.285 . . . . 0.0 113.421 -176.316 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -77.04 151.86 35.36 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.164 0.986 . . . . 0.0 110.192 169.681 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -165.32 146.89 11.64 Favored Glycine 0 CA--C 1.527 0.834 0 N-CA-C 115.221 0.848 . . . . 0.0 115.221 176.553 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -137.58 -14.03 1.48 Allowed 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 114.687 1.365 . . . . 0.0 114.687 -175.645 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 5.9 mtm -176.45 126.35 0.19 Allowed 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 128.44 2.696 . . . . 0.0 109.658 -176.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -170.42 152.03 3.89 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 114.507 1.299 . . . . 0.0 114.507 176.572 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 42.9 p -75.41 175.32 8.55 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 126.351 1.861 . . . . 0.0 113.163 176.358 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 8.9 t -54.54 -50.1 61.29 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 O-C-N 120.614 -1.304 . . . . 0.0 110.401 169.246 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -56.43 -37.37 70.12 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.287 0.949 . . . . 0.0 112.587 -177.712 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -79.23 -30.79 43.38 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.687 1.195 . . . . 0.0 113.474 176.013 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 49.6 t -75.28 -46.05 39.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.124 0.97 . . . . 0.0 111.777 176.674 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 29.4 mmt -62.36 -26.81 68.66 Favored 'General case' 0 N--CA 1.483 1.221 0 CA-C-N 119.907 1.231 . . . . 0.0 113.116 -177.71 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -51.56 -52.95 43.04 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.18 170.62 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -74.88 -36.99 62.25 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 170.466 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -75.18 -41.47 57.94 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 120.831 -1.168 . . . . 0.0 112.898 -171.578 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -64.11 -35.92 92.59 Favored Glycine 0 CA--C 1.531 1.052 0 O-C-N 121.654 -0.654 . . . . 0.0 111.814 171.469 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 9.1 tp60 -64.48 -44.55 90.65 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.679 1.191 . . . . 0.0 111.912 171.314 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.453 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 42.6 t80 -60.21 -48.84 80.04 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.637 0.775 . . . . 0.0 110.364 175.225 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 58.1 mt -63.04 -35.27 70.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 124.108 0.963 . . . . 0.0 111.241 177.402 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.0 tpt -65.57 -35.7 81.62 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.447 1.099 . . . . 0.0 112.516 173.17 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 64.0 t -78.35 -47.74 23.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 O-C-N 120.848 -1.158 . . . . 0.0 112.29 175.11 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 18.2 mmtp -80.62 -13.43 59.05 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.52 1.128 . . . . 0.0 112.624 -174.483 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 51.79 63.95 2.04 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 127.901 2.48 . . . . 0.0 113.434 176.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 37.1 mt -86.6 -11.27 51.93 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.726 0.81 . . . . 0.0 112.729 178.721 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 45.4 p90 -84.73 154.61 22.33 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.208 1.003 . . . . 0.0 111.632 175.245 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -88.42 129.15 35.5 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 169.285 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.75 -31.02 57.97 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 113.876 1.065 . . . . 0.0 113.876 179.23 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -93.91 -17.71 22.71 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.721 1.209 . . . . 0.0 112.702 -172.141 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -140.84 64.01 1.44 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.837 2.455 . . . . 0.0 109.677 -177.745 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -62.96 -18.06 62.75 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 -171.27 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 27.7 p80 -61.1 -32.03 71.71 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.624 0.77 . . . . 0.0 112.761 169.839 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 7.1 ttm -89.26 136.78 32.83 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.516 1.126 . . . . 0.0 112.021 178.804 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 3.6 t -122.19 126.58 74.52 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 C-N-CA 125.906 1.682 . . . . 0.0 108.3 172.818 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -106.22 101.43 10.91 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.396 1.078 . . . . 0.0 109.929 178.21 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 13.7 m -101.28 9.52 41.66 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.673 0.789 . . . . 0.0 112.976 -179.189 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.87 -27.92 65.12 Favored Glycine 0 CA--C 1.54 1.646 0 O-C-N 120.912 -1.118 . . . . 0.0 114.169 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -94.13 7.09 72.75 Favored Glycine 0 CA--C 1.541 1.674 0 C-N-CA 125.527 1.537 . . . . 0.0 115.07 171.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -105.97 167.24 9.93 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.109 1.764 . . . . 0.0 112.3 -176.638 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -46.43 -43.33 16.37 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 126.22 1.808 . . . . 0.0 111.7 169.763 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 81.0 mt -60.24 -39.86 88.21 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.135 0.574 . . . . 0.0 112.44 176.079 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -69.65 -37.98 77.55 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 124.573 1.082 . . . . 0.0 113.784 174.793 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -63.77 -42.73 97.75 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 120.133 1.966 . . . . 0.0 110.897 173.826 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 29.6 tp -62.06 -49.08 77.42 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 126.096 1.758 . . . . 0.0 112.85 179.619 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -105.28 -6.85 19.33 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.707 1.203 . . . . 0.0 113.521 -171.105 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 78.66 -30.06 2.0 Favored Glycine 0 CA--C 1.54 1.643 0 O-C-N 120.254 -1.529 . . . . 0.0 113.564 -169.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.94 132.03 9.98 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 127.942 2.497 . . . . 0.0 110.414 176.629 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -144.4 35.03 1.18 Allowed 'General case' 0 N--CA 1.476 0.843 0 CA-C-O 121.901 0.858 . . . . 0.0 110.426 176.745 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.2 m -99.0 139.37 34.74 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.381 0.673 . . . . 0.0 111.178 179.59 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 53.9 p90 -163.56 177.24 8.96 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.801 1.24 . . . . 0.0 112.77 -168.763 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 29.8 t -128.47 141.22 51.46 Favored 'General case' 0 CA--C 1.52 -0.208 0 C-N-CA 124.37 1.068 . . . . 0.0 110.921 168.828 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 22.7 m -72.25 -9.95 13.45 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 177.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 43.8 pttt -77.11 -10.86 59.66 Favored 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 169.719 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 44.0 t0 -123.4 77.45 53.9 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 126.431 1.893 . . . . 0.0 109.615 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -70.0 -25.73 27.19 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 123.406 2.737 . . . . 0.0 114.954 -169.38 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 49.4 m -61.28 -53.47 62.46 Favored Pre-proline 0 N--CA 1.476 0.834 0 CA-C-N 119.867 1.212 . . . . 0.0 114.119 -177.486 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -66.05 -32.13 44.62 Favored 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.081 1.854 . . . . 0.0 113.011 176.497 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 39.1 tp -63.4 -51.49 65.57 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.63 1.172 . . . . 0.0 110.079 175.521 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 68.4 t80 -54.75 -45.92 74.26 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.437 1.095 . . . . 0.0 112.281 171.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -65.27 -35.81 82.17 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 114.077 1.139 . . . . 0.0 114.077 -175.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 55.1 mtm -68.85 -49.78 55.42 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 120.925 0.393 . . . . 0.0 111.401 169.662 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.2 mp -61.11 -29.59 69.85 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 124.805 1.242 . . . . 0.0 112.463 -179.138 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 13.7 ttm-85 -52.12 -28.4 17.68 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.701 1.6 . . . . 0.0 113.173 169.588 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -88.4 -23.41 23.34 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.496 1.518 . . . . 0.0 114.153 173.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 27.0 m120 -123.9 -22.54 4.85 Favored 'General case' 0 N--CA 1.486 1.364 0 N-CA-C 117.141 2.275 . . . . 0.0 117.141 -169.154 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 60.0 tp . . . . . 0 CA--C 1.545 0.756 0 C-N-CA 126.641 1.976 . . . . 0.0 111.588 -169.305 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.8 m . . . . . 0 N--CA 1.479 0.993 0 CA-C-O 120.719 0.295 . . . . 0.0 111.62 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 44.9 ttp180 -104.99 136.74 19.12 Favored Pre-proline 0 N--CA 1.479 0.976 0 C-N-CA 124.711 1.204 . . . . 0.0 110.994 177.157 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -75.99 177.93 8.1 Favored 'Trans proline' 0 CA--C 1.537 0.629 0 C-N-CA 123.171 2.581 . . . . 0.0 112.331 171.493 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.5 ttmt -63.0 148.26 48.21 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.686 0.794 . . . . 0.0 110.219 176.279 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 85.3 mt -58.17 -43.17 98.09 Favored Pre-proline 0 N--CA 1.475 0.811 0 N-CA-C 114.74 1.385 . . . . 0.0 114.74 -169.083 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -64.45 -27.24 62.48 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 CA-C-N 122.581 1.958 . . . . 0.0 114.04 174.539 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.9 tt -70.11 -38.84 75.7 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 120.914 -1.116 . . . . 0.0 110.014 171.079 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.9 tp -60.12 -38.63 83.6 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 121.264 -0.898 . . . . 0.0 111.808 170.069 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.423 ' HA ' ' HE2' ' A' ' 35' ' ' LYS . 8.8 mmpt? -64.05 -40.85 97.19 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.769 0.828 . . . . 0.0 112.429 173.034 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 76.0 mt -62.93 -40.31 88.44 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 124.658 1.183 . . . . 0.0 111.624 175.053 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 77.6 mt -64.0 -40.71 96.98 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 121.053 -1.03 . . . . 0.0 112.846 170.364 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 51.4 m170 -60.43 -43.99 96.23 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 119.241 0.928 . . . . 0.0 111.688 171.729 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -65.64 -25.57 67.42 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.504 1.121 . . . . 0.0 113.059 179.182 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.426 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -73.74 -4.42 34.4 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 123.988 0.915 . . . . 0.0 113.442 172.109 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.35 9.17 65.4 Favored Glycine 0 CA--C 1.536 1.367 0 C-N-CA 125.298 1.428 . . . . 0.0 114.8 -179.622 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -98.51 144.93 27.3 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.662 1.185 . . . . 0.0 112.277 179.668 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.6 tp60 -73.77 136.46 43.61 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 121.456 -0.778 . . . . 0.0 109.626 169.445 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -110.5 93.06 0.71 Allowed Glycine 0 CA--C 1.522 0.517 0 N-CA-C 114.317 0.487 . . . . 0.0 114.317 -172.334 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -146.85 73.64 1.32 Allowed 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.532 1.533 . . . . 0.0 109.939 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 25.7 mtm 65.35 134.31 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 129.77 3.228 . . . . 0.0 117.082 171.101 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -163.45 163.35 24.89 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 114.052 1.131 . . . . 0.0 114.052 -170.141 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 31.9 p -78.01 170.99 15.68 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.077 1.351 . . . . 0.0 112.458 172.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -53.32 -41.74 45.03 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 O-C-N 121.118 -0.989 . . . . 0.0 111.35 169.901 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -68.22 -42.95 79.02 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.517 1.127 . . . . 0.0 112.643 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -67.03 -39.28 86.98 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.332 0.653 . . . . 0.0 112.141 177.23 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 54.5 t -62.44 -46.43 96.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 123.873 0.869 . . . . 0.0 110.838 170.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.78 -37.52 86.55 Favored 'General case' 0 N--CA 1.458 -0.071 0 C-N-CA 126.243 1.817 . . . . 0.0 114.027 -175.178 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 84.4 t60 -51.62 -51.12 58.17 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 122.677 0.391 . . . . 0.0 111.498 172.93 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 54.5 m-85 -74.74 -33.2 62.31 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 114.522 1.304 . . . . 0.0 114.522 174.424 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.68 -42.79 77.33 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 120.703 1.592 . . . . 0.0 112.905 178.517 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.04 -44.0 98.38 Favored Glycine 0 CA--C 1.53 1.008 0 N-CA-C 111.548 -0.621 . . . . 0.0 111.548 173.272 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.7 tp60 -60.27 -42.05 94.59 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.449 1.099 . . . . 0.0 112.429 172.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.426 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 68.3 t80 -64.6 -51.66 61.57 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.837 1.255 . . . . 0.0 110.718 178.922 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 59.8 mt -62.09 -37.47 78.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 C-N-CA 123.855 0.862 . . . . 0.0 110.398 178.707 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -63.58 -47.3 82.07 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.492 1.117 . . . . 0.0 112.748 174.247 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.0 p -78.43 -28.06 14.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 124.111 0.965 . . . . 0.0 113.5 -174.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 20.9 mmtp -95.48 -12.03 26.53 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.317 1.447 . . . . 0.0 113.826 174.779 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 16.5 mp0 55.37 61.41 2.89 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.612 1.965 . . . . 0.0 113.632 -177.925 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 40.2 mt -92.77 4.53 53.63 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.543 0.737 . . . . 0.0 112.907 173.708 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 51.7 p90 -89.46 153.67 20.64 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.362 1.465 . . . . 0.0 110.531 169.706 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -79.69 122.29 26.37 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.732 -0.605 . . . . 0.0 109.381 169.556 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 4.6 pm0 -61.86 -34.83 76.7 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.732 1.012 . . . . 0.0 113.732 -174.229 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -82.86 -25.21 32.79 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.614 0.766 . . . . 0.0 111.799 -175.905 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -139.98 74.51 1.47 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.998 2.119 . . . . 0.0 110.682 -179.231 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -58.23 -14.93 8.19 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 114.697 1.369 . . . . 0.0 114.697 -178.614 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 21.7 p80 -67.8 -1.91 6.25 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 117.995 -1.002 . . . . 0.0 113.668 169.462 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 14.8 ttm -117.74 140.01 50.27 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.933 1.693 . . . . 0.0 113.284 169.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 54.8 t -115.71 142.42 28.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 127.572 2.349 . . . . 0.0 109.608 169.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -123.04 52.83 1.33 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.287 1.435 . . . . 0.0 112.135 -173.194 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 67.9 m -75.16 2.41 10.9 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 120.748 -1.22 . . . . 0.0 114.277 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.36 -23.64 54.06 Favored Glycine 0 CA--C 1.539 1.586 0 CA-C-N 120.155 1.343 . . . . 0.0 114.655 173.719 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -88.34 2.46 85.05 Favored Glycine 0 CA--C 1.54 1.651 0 C-N-CA 124.964 1.269 . . . . 0.0 115.34 171.765 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -111.56 -174.42 2.46 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 119.158 1.479 . . . . 0.0 113.217 -172.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -63.92 -33.9 76.74 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 120.873 -1.142 . . . . 0.0 111.759 176.402 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.5 tp -65.22 -38.61 90.96 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-O 121.821 0.819 . . . . 0.0 110.207 173.669 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -64.02 -40.63 98.37 Favored Glycine 0 CA--C 1.532 1.138 0 C-N-CA 125.074 1.321 . . . . 0.0 113.602 171.468 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -73.07 -29.42 62.95 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 120.248 2.024 . . . . 0.0 112.009 177.559 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 23.7 tp -65.57 -50.01 66.73 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.023 1.329 . . . . 0.0 111.65 172.446 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.45 -5.78 31.74 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 -173.604 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 77.74 -28.19 1.86 Allowed Glycine 0 CA--C 1.54 1.652 0 C-N-CA 125.502 1.525 . . . . 0.0 113.627 -170.475 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.3 128.83 9.22 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 127.925 2.49 . . . . 0.0 110.451 175.499 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -140.63 40.57 1.86 Allowed 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.608 1.163 . . . . 0.0 110.072 175.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 10.7 m -103.77 132.22 50.23 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 169.853 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 40.1 p90 -163.51 169.32 18.94 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.219 1.407 . . . . 0.0 112.384 -167.899 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 17.2 m -107.64 135.3 49.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 122.396 1.093 . . . . 0.0 110.95 173.114 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -78.16 -23.4 13.66 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 C-N-CA 125.839 1.656 . . . . 0.0 113.332 -169.921 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.7 pttt -79.97 -5.28 55.39 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 126.299 1.84 . . . . 0.0 115.333 179.12 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 42.8 t0 -116.21 86.32 17.17 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 126.373 1.869 . . . . 0.0 110.735 -170.786 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -61.1 -36.94 79.12 Favored 'Trans proline' 0 CA--C 1.537 0.674 0 C-N-CA 124.29 3.327 . . . . 0.0 115.423 -170.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 67.9 m -58.95 -54.91 51.72 Favored Pre-proline 0 N--CA 1.477 0.894 0 CA-C-N 119.848 1.204 . . . . 0.0 114.076 -175.441 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -70.05 -24.75 27.98 Favored 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 121.956 1.771 . . . . 0.0 112.97 175.415 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 24.0 tp -67.83 -48.94 64.81 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.323 1.049 . . . . 0.0 110.822 178.586 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 22.9 m-30 -62.5 -35.71 80.25 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.856 0.862 . . . . 0.0 112.572 177.91 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -59.88 -42.32 93.52 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.002 0.921 . . . . 0.0 112.735 178.376 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.424 ' HB2' ' HE2' ' A' ' 101' ' ' MET . 35.4 mtm -72.01 -48.67 43.01 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.795 0.838 . . . . 0.0 112.521 172.727 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -59.13 -39.59 82.83 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-O 117.793 -1.099 . . . . 0.0 110.974 -175.596 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 76.6 mtt180 -54.71 -25.48 27.73 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 171.527 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -87.67 -24.1 24.01 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.437 1.495 . . . . 0.0 114.081 173.505 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -111.05 -28.38 8.34 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 114.112 1.152 . . . . 0.0 114.112 -170.883 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 3.2 tt . . . . . 0 CA--C 1.544 0.712 0 C-N-CA 127.587 2.355 . . . . 0.0 108.021 -177.123 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 35.7 m . . . . . 0 N--CA 1.479 0.995 0 CA-C-O 120.854 0.359 . . . . 0.0 111.548 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.8 ttp-105 -93.73 137.15 23.31 Favored Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 125.405 1.482 . . . . 0.0 111.438 178.113 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -75.81 177.98 8.01 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 124.36 3.374 . . . . 0.0 113.843 -178.129 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.9 ttmt -61.82 147.08 47.62 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.366 1.066 . . . . 0.0 110.549 175.708 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.3 mp -54.07 -48.09 95.16 Favored Pre-proline 0 N--CA 1.472 0.67 0 N-CA-C 115.016 1.487 . . . . 0.0 115.016 -168.382 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -60.56 -31.26 92.1 Favored 'Trans proline' 0 CA--C 1.537 0.642 0 CA-C-N 122.053 1.769 . . . . 0.0 113.796 177.131 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 7.5 tt -77.59 -34.7 53.49 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 120.941 -1.1 . . . . 0.0 111.381 177.42 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 45.1 tp -61.36 -38.53 87.28 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.697 -0.627 . . . . 0.0 111.005 169.304 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -66.57 -35.58 80.56 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.83 0.852 . . . . 0.0 113.042 174.428 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 93.5 mt -60.55 -45.48 97.08 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 CA-C-N 119.41 1.004 . . . . 0.0 111.061 169.607 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.1 mp -69.22 -30.79 69.03 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 121.047 -1.033 . . . . 0.0 112.864 177.635 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 30.1 m170 -67.39 -42.88 82.62 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.188 -0.945 . . . . 0.0 111.557 169.693 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.23 -25.33 68.02 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.18 0.992 . . . . 0.0 113.117 174.805 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.411 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -69.62 -9.17 53.06 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 171.282 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 78.65 19.99 72.27 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 125.144 1.354 . . . . 0.0 114.254 -177.484 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -108.23 7.62 27.47 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 116.048 1.87 . . . . 0.0 116.048 -169.681 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.427 ' HG2' ' H ' ' A' ' 44' ' ' GLY . 7.3 tt0 48.85 -159.43 0.05 Allowed 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 126.069 1.748 . . . . 0.0 111.211 -169.218 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLY . . . . . 0.427 ' H ' ' HG2' ' A' ' 43' ' ' GLN . . . 165.36 134.66 1.7 Allowed Glycine 0 N--CA 1.469 0.84 0 O-C-N 120.49 -1.381 . . . . 0.0 115.369 169.827 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -138.67 -19.99 1.03 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.794 1.238 . . . . 0.0 114.143 174.657 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 3.8 mtm -174.5 131.41 0.36 Allowed 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 128.0 2.52 . . . . 0.0 109.899 -178.583 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -163.56 152.4 14.08 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 114.569 1.322 . . . . 0.0 114.569 173.943 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 67.4 p -82.26 174.68 10.94 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 128.153 2.581 . . . . 0.0 112.343 174.39 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -53.06 -50.37 45.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 CA-C-N 119.908 1.231 . . . . 0.0 109.9 169.046 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 59.1 tptt -55.43 -37.87 68.23 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 119.043 0.838 . . . . 0.0 112.675 -176.556 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -80.4 -38.85 29.48 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.524 1.13 . . . . 0.0 113.265 175.69 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 41.9 t -68.11 -50.41 58.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 O-C-N 121.303 -0.873 . . . . 0.0 111.357 -179.195 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.7 mmm -68.66 -23.91 64.47 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 119.344 0.975 . . . . 0.0 112.642 -173.609 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -58.9 -55.6 33.07 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.657 0.783 . . . . 0.0 111.303 169.906 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -74.46 -32.08 62.47 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 177.465 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.83 -38.57 76.59 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 120.881 -1.137 . . . . 0.0 111.12 174.911 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.85 -42.05 99.75 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 124.194 0.902 . . . . 0.0 112.41 171.422 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.8 tp60 -60.37 -43.63 96.37 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.226 1.011 . . . . 0.0 112.11 171.397 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.411 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 61.6 t80 -60.44 -52.49 64.99 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.838 0.855 . . . . 0.0 110.788 174.727 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 44.0 mt -60.17 -37.04 71.75 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 124.084 0.954 . . . . 0.0 111.071 179.167 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -64.33 -46.6 82.79 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.372 1.069 . . . . 0.0 112.401 174.17 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.5 p -78.51 -28.52 14.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 N-CA-C 113.66 0.985 . . . . 0.0 113.66 -176.032 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 57.3 mmtt -91.88 -15.83 27.56 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.148 1.379 . . . . 0.0 113.731 175.038 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 14.1 mp0 54.23 73.26 0.4 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.973 2.109 . . . . 0.0 113.227 -172.209 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.3 tp -94.62 18.56 11.27 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.892 1.277 . . . . 0.0 112.484 178.542 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 51.2 p90 -127.53 160.3 31.94 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.628 1.971 . . . . 0.0 111.348 -173.796 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -81.34 124.74 29.62 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 121.567 -0.708 . . . . 0.0 111.176 172.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.02 -20.19 56.55 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 174.074 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -80.7 -36.69 31.9 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.732 0.813 . . . . 0.0 111.433 -176.823 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -149.55 92.38 1.92 Allowed 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 127.439 2.296 . . . . 0.0 109.441 -176.099 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 27.5 mp0 -65.59 -12.41 52.88 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 -169.934 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 24.3 p80 -66.01 -23.26 66.53 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 170.443 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 1.9 tpt -81.69 118.84 23.15 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.818 1.647 . . . . 0.0 110.498 175.871 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 18.2 t -104.14 130.64 54.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 125.904 1.682 . . . . 0.0 108.286 171.158 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 79.5 t80 -132.45 112.6 12.28 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.227 1.011 . . . . 0.0 109.686 -177.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 23.0 p -76.67 -28.98 56.17 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 114.539 1.311 . . . . 0.0 114.539 -169.426 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 50.87 -123.84 18.28 Favored Glycine 0 CA--C 1.539 1.567 0 CA-C-N 119.161 0.891 . . . . 0.0 112.136 -173.225 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -87.77 12.46 63.56 Favored Glycine 0 CA--C 1.542 1.733 0 C-N-CA 125.433 1.492 . . . . 0.0 116.214 176.745 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -63.12 159.38 17.55 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 119.746 1.773 . . . . 0.0 113.31 -179.63 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.1 mp -49.17 -37.37 22.18 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.799 1.64 . . . . 0.0 113.465 171.864 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 89.5 mt -59.76 -44.83 93.67 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 118.911 0.778 . . . . 0.0 111.405 175.511 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -73.14 -36.73 56.1 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 124.248 0.928 . . . . 0.0 113.099 176.079 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.29 -28.36 66.21 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 119.782 1.791 . . . . 0.0 112.191 178.762 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 42.9 tp -80.07 -54.53 5.69 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 124.289 1.036 . . . . 0.0 112.71 172.601 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -88.98 -7.03 56.77 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 123.846 0.858 . . . . 0.0 113.267 -172.095 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.41 -28.61 3.01 Favored Glycine 0 CA--C 1.54 1.605 0 C-N-CA 125.568 1.556 . . . . 0.0 113.001 -169.495 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.92 139.06 6.09 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 127.67 2.388 . . . . 0.0 111.6 -179.335 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -147.19 54.91 1.09 Allowed 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.904 1.282 . . . . 0.0 109.96 168.8 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 6.8 m -104.79 130.74 52.83 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-O 121.168 0.509 . . . . 0.0 109.793 169.46 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 54.4 p90 -168.22 177.04 5.65 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.786 1.634 . . . . 0.0 111.458 -168.299 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 67.2 p -121.55 143.24 49.4 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 174.205 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 20.5 m -71.28 -15.18 18.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 N-CA-C 113.996 1.11 . . . . 0.0 113.996 -173.19 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.0 pttt -77.59 -8.12 57.37 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 126.335 1.854 . . . . 0.0 114.419 172.076 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 44.6 t0 -119.6 78.17 21.0 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 126.142 1.777 . . . . 0.0 110.516 -177.199 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -68.56 -27.61 32.68 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 123.756 2.971 . . . . 0.0 115.288 -169.679 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 63.7 m -59.35 -54.39 56.62 Favored Pre-proline 0 N--CA 1.478 0.933 0 CA-C-N 120.341 1.428 . . . . 0.0 113.753 -177.504 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -66.46 -28.9 45.61 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 121.797 1.664 . . . . 0.0 112.585 173.799 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.97 -52.88 63.84 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.793 1.237 . . . . 0.0 110.631 176.006 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -66.48 -29.28 69.36 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.94 0.896 . . . . 0.0 113.379 174.813 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -61.76 -50.38 72.61 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.699 1.591 . . . . 0.0 112.377 174.48 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 36.4 mtm -65.53 -43.08 91.1 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.026 0.53 . . . . 0.0 111.595 175.147 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 42.8 mt -66.04 -42.27 89.8 Favored 'General case' 0 C--O 1.218 -0.578 0 CA-C-O 117.174 -1.393 . . . . 0.0 112.052 -179.224 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -56.02 -29.03 59.78 Favored 'General case' 0 N--CA 1.484 1.255 0 CA-C-N 121.347 1.885 . . . . 0.0 113.613 173.257 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -82.71 -17.6 43.85 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.518 1.527 . . . . 0.0 113.424 175.321 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -120.87 -15.0 8.41 Favored 'General case' 0 CA--C 1.556 1.196 0 N-CA-C 115.292 1.59 . . . . 0.0 115.292 -172.723 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 29.6 tp . . . . . 0 CA--C 1.545 0.75 0 C-N-CA 130.484 3.514 . . . . 0.0 108.598 -171.936 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 35.5 m . . . . . 0 N--CA 1.48 1.03 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 84.1 mtm-85 -91.75 138.63 24.92 Favored Pre-proline 0 N--CA 1.479 0.992 0 C-N-CA 124.432 1.093 . . . . 0.0 111.167 176.33 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -80.92 171.88 13.73 Favored 'Trans proline' 0 CA--C 1.538 0.679 0 C-N-CA 123.986 3.124 . . . . 0.0 113.038 178.361 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.03 149.43 15.51 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.664 0.786 . . . . 0.0 112.475 173.674 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 92.5 mt -59.85 -50.03 88.6 Favored Pre-proline 0 N--CA 1.476 0.875 0 N-CA-C 114.099 1.148 . . . . 0.0 114.099 -175.015 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -67.33 -21.34 47.65 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 121.897 1.731 . . . . 0.0 113.118 174.515 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.4 tt -69.66 -46.03 67.04 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 118.944 0.793 . . . . 0.0 109.826 170.226 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.2 tp -60.31 -31.76 70.58 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 120.865 -1.147 . . . . 0.0 112.955 176.467 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.62 -28.85 68.84 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 121.493 -0.754 . . . . 0.0 112.678 171.559 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 45.0 mt -71.03 -43.89 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 CA-C-N 119.073 0.851 . . . . 0.0 110.573 173.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.88 -38.94 87.4 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.485 0.714 . . . . 0.0 110.733 175.863 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 53.3 m170 -66.46 -43.83 84.44 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.426 0.69 . . . . 0.0 112.457 172.301 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.43 -27.99 69.67 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.945 0.898 . . . . 0.0 113.376 176.606 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.426 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -72.74 -5.22 36.29 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 124.222 1.009 . . . . 0.0 113.475 172.834 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.54 9.04 65.18 Favored Glycine 0 CA--C 1.537 1.456 0 C-N-CA 125.422 1.487 . . . . 0.0 115.102 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -97.96 165.67 11.81 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.752 1.221 . . . . 0.0 112.952 179.341 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 21.7 tm0? -118.03 145.22 44.94 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.65 1.58 . . . . 0.0 109.335 169.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -171.77 158.46 29.34 Favored Glycine 0 N--CA 1.467 0.724 0 N-CA-C 116.287 1.275 . . . . 0.0 116.287 -169.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -140.44 -63.69 0.48 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.987 1.715 . . . . 0.0 109.643 169.495 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 3.3 mpp? -101.63 141.7 34.1 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 127.14 2.176 . . . . 0.0 112.183 179.304 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 25.0 m-85 -154.41 159.78 41.28 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.369 1.067 . . . . 0.0 113.678 -175.261 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 71.3 p -95.21 175.02 6.77 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.353 1.461 . . . . 0.0 108.052 166.111 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -59.08 -40.18 80.24 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 O-C-N 120.011 -1.681 . . . . 0.0 109.981 169.148 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -59.8 -43.99 94.18 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.768 1.227 . . . . 0.0 112.756 178.33 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -72.67 -36.74 67.99 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 178.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 75.3 t -65.73 -51.95 56.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 CA-C-N 119.388 0.995 . . . . 0.0 110.669 171.36 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.4 ppp? -68.88 -26.06 64.93 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -169.191 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 82.8 t60 -60.18 -53.49 57.09 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 119.101 0.864 . . . . 0.0 111.27 172.696 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 57.3 m-85 -74.4 -30.38 61.92 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 178.737 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -68.64 -39.76 80.57 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.326 0.966 . . . . 0.0 112.735 172.803 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.52 -43.58 97.9 Favored Glycine 0 CA--C 1.532 1.132 0 CA-C-N 118.761 0.71 . . . . 0.0 111.722 172.639 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 36.1 tp60 -58.67 -45.35 89.61 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.104 0.961 . . . . 0.0 112.156 170.499 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.426 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 51.7 t80 -60.62 -51.59 68.75 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.708 0.803 . . . . 0.0 110.433 177.784 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 48.7 mt -59.19 -38.87 76.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 124.368 1.067 . . . . 0.0 111.039 178.188 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.0 tpt -64.57 -45.3 87.62 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.387 1.075 . . . . 0.0 112.726 175.05 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.1 p -78.67 -29.54 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-N 119.703 1.138 . . . . 0.0 113.716 -177.024 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 58.0 mmtt -90.74 -15.91 29.38 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.806 1.242 . . . . 0.0 113.36 175.356 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 14.1 mp0 50.89 73.73 0.27 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 127.182 2.193 . . . . 0.0 112.856 -172.624 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 11.8 tp -87.44 -4.45 59.01 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.855 0.862 . . . . 0.0 112.187 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 51.3 p90 -99.18 160.0 14.58 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.53 1.932 . . . . 0.0 111.784 177.92 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -91.99 134.28 34.95 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 169.29 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -59.6 -32.21 70.18 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -174.471 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -86.62 -20.49 27.78 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 123.795 0.838 . . . . 0.0 112.578 -169.88 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -140.37 63.28 1.47 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 127.985 2.514 . . . . 0.0 110.257 -178.841 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -60.22 -19.77 55.89 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.966 0.906 . . . . 0.0 113.254 -179.238 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 31.8 p80 -63.09 -7.32 5.35 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.43 1.092 . . . . 0.0 113.889 170.488 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 39.4 mtp -121.0 149.25 42.95 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.35 1.46 . . . . 0.0 112.926 169.287 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.9 p -124.1 144.37 34.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 126.075 1.75 . . . . 0.0 109.62 173.348 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -128.73 110.13 11.92 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.792 1.237 . . . . 0.0 110.586 -170.559 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 19.8 p -78.61 17.09 0.73 Allowed 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 116.723 2.12 . . . . 0.0 116.723 -168.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -53.57 113.14 2.83 Favored Glycine 0 CA--C 1.537 1.438 0 CA-C-N 119.577 1.08 . . . . 0.0 113.605 -172.696 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 73.6 9.34 78.28 Favored Glycine 0 CA--C 1.541 1.665 0 C-N-CA 124.979 1.276 . . . . 0.0 115.791 -177.872 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -86.88 158.67 19.28 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 119.355 1.577 . . . . 0.0 113.531 -175.729 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 27.9 mt -54.31 -37.22 64.59 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.926 1.29 . . . . 0.0 113.126 169.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.61 -42.34 96.63 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.373 -0.829 . . . . 0.0 111.347 174.334 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -70.49 -34.01 67.89 Favored Glycine 0 CA--C 1.532 1.109 0 CA-C-O 118.609 -1.106 . . . . 0.0 112.986 175.719 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -71.62 -29.24 64.45 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 120.218 2.009 . . . . 0.0 111.79 175.205 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 27.7 tp -71.32 -53.09 15.4 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 124.777 1.231 . . . . 0.0 112.419 174.218 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -102.49 -9.74 19.97 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.085 1.143 . . . . 0.0 114.085 -169.667 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.03 -32.89 1.97 Allowed Glycine 0 CA--C 1.54 1.625 0 C-N-CA 124.896 1.236 . . . . 0.0 112.57 -169.074 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.45 123.19 8.62 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 126.777 2.031 . . . . 0.0 112.553 174.923 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 -136.86 33.8 2.65 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.595 1.558 . . . . 0.0 111.172 177.837 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 11.4 m -94.14 132.37 38.74 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 169.702 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 49.6 p90 -162.35 172.33 15.8 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.335 1.054 . . . . 0.0 112.961 -169.449 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 81.6 p -116.19 136.42 53.03 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 122.452 1.12 . . . . 0.0 113.586 175.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -78.05 -17.69 13.86 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.442 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 -174.668 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.5 pttt -72.8 -8.47 55.63 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.666 1.586 . . . . 0.0 114.637 175.42 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -120.57 83.36 34.58 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 126.386 1.875 . . . . 0.0 110.147 -177.178 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -68.12 -25.2 37.74 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.862 3.041 . . . . 0.0 115.224 -169.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 62.5 m -63.52 -54.89 39.55 Favored Pre-proline 0 N--CA 1.476 0.875 0 CA-C-N 119.813 1.188 . . . . 0.0 113.87 -178.445 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -65.5 -30.38 52.37 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 121.827 1.685 . . . . 0.0 112.553 175.396 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 22.4 tp -62.61 -47.95 81.54 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.983 0.913 . . . . 0.0 111.11 174.789 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -59.99 -37.98 81.27 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 121.489 -0.757 . . . . 0.0 112.179 173.86 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -64.28 -47.26 80.22 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.043 0.937 . . . . 0.0 112.939 176.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.453 ' HB2' ' HE2' ' A' ' 101' ' ' MET . 3.9 mtp -56.9 -44.46 82.38 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.335 1.054 . . . . 0.0 112.111 172.293 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.1 mp -62.53 -47.17 85.06 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.392 1.077 . . . . 0.0 110.567 176.372 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 14.8 mtt180 -56.98 -21.64 31.96 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.68 1.192 . . . . 0.0 114.142 171.011 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -98.57 -5.17 32.54 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 126.396 1.878 . . . . 0.0 115.01 175.342 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 18.9 p30 -115.88 -27.6 6.95 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 120.349 1.432 . . . . 0.0 114.479 175.347 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 39.8 tp . . . . . 0 CA--C 1.548 0.874 0 C-N-CA 126.565 1.946 . . . . 0.0 111.905 175.801 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 33.5 m . . . . . 0 N--CA 1.48 1.036 0 CA-C-O 121.055 0.455 . . . . 0.0 111.706 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.7 ttp-105 -87.11 133.04 39.83 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 124.693 1.197 . . . . 0.0 111.721 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -73.19 175.8 10.04 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 123.586 2.857 . . . . 0.0 112.228 173.415 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.5 tpmt? -61.52 147.31 45.82 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.472 0.709 . . . . 0.0 110.605 177.899 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -59.32 -40.63 82.05 Favored Pre-proline 0 N--CA 1.473 0.714 0 CA-C-O 117.32 -1.324 . . . . 0.0 114.239 -170.265 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -61.06 -33.85 91.06 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 121.994 1.796 . . . . 0.0 113.696 173.226 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.2 tt -70.12 -40.75 74.7 Favored 'General case' 0 CA--C 1.546 0.804 0 O-C-N 121.469 -0.769 . . . . 0.0 109.666 175.913 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.8 tt -63.91 -35.4 80.54 Favored 'General case' 0 N--CA 1.475 0.825 0 O-C-N 120.858 -1.151 . . . . 0.0 112.791 172.367 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.66 -38.91 92.15 Favored 'General case' 0 N--CA 1.48 1.026 0 O-C-N 121.216 -0.928 . . . . 0.0 112.223 170.684 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 91.8 mt -67.06 -38.33 81.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 123.676 0.79 . . . . 0.0 111.636 174.065 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 77.0 mt -61.99 -40.73 96.63 Favored 'General case' 0 CA--C 1.544 0.75 0 O-C-N 121.107 -0.996 . . . . 0.0 112.142 170.804 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 34.8 m170 -62.22 -42.95 99.77 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 119.332 0.969 . . . . 0.0 112.293 170.03 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.25 -25.43 68.05 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 177.832 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.56 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -72.91 -7.37 50.66 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 172.888 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 89.4 6.35 71.02 Favored Glycine 0 CA--C 1.537 1.449 0 C-N-CA 125.228 1.394 . . . . 0.0 114.584 -175.652 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -87.71 177.86 6.91 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.706 1.202 . . . . 0.0 112.263 175.279 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.96 149.3 43.12 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.257 1.423 . . . . 0.0 109.942 172.339 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 176.12 161.68 25.68 Favored Glycine 0 CA--C 1.527 0.802 0 N-CA-C 116.791 1.476 . . . . 0.0 116.791 170.475 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -125.65 8.52 7.62 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 126.018 1.727 . . . . 0.0 112.444 171.265 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.1 mtm -170.95 135.36 1.03 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 128.888 2.875 . . . . 0.0 109.055 -177.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -149.27 144.39 26.47 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -176.726 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 46.6 p -86.59 169.47 12.73 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.471 1.108 . . . . 0.0 111.304 168.616 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.1 t -56.16 -46.18 81.06 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 O-C-N 120.661 -1.274 . . . . 0.0 109.943 169.338 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -56.59 -35.93 68.8 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.721 0.808 . . . . 0.0 113.074 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -77.32 -46.16 23.82 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 173.195 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 74.8 t -63.93 -49.45 81.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 O-C-N 121.451 -0.781 . . . . 0.0 111.756 -177.219 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -71.24 -27.28 63.36 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 119.89 1.223 . . . . 0.0 112.287 -172.261 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -58.81 -54.45 46.95 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.345 0.658 . . . . 0.0 111.118 170.528 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -74.35 -32.29 62.73 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 178.782 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -68.05 -41.98 81.19 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 119.996 1.271 . . . . 0.0 111.823 173.591 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -61.36 -47.28 91.67 Favored Glycine 0 CA--C 1.527 0.81 0 CA-C-N 119.018 0.826 . . . . 0.0 111.624 173.623 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.3 tp60 -55.97 -47.9 76.8 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.384 1.073 . . . . 0.0 112.094 172.617 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.56 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 47.9 t80 -60.36 -48.79 80.25 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.121 0.968 . . . . 0.0 110.894 177.609 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 58.3 mt -60.85 -36.93 74.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 125.21 1.404 . . . . 0.0 111.148 178.244 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 35.3 mmt -66.34 -38.52 87.83 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.551 1.068 . . . . 0.0 113.051 171.304 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 82.2 t -78.31 -32.21 16.66 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 CA-C-N 119.217 0.917 . . . . 0.0 112.906 -178.181 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 47.2 mmtt -91.47 -15.54 28.67 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.159 1.383 . . . . 0.0 113.0 177.138 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.5 mp0 52.3 63.98 2.03 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.344 1.857 . . . . 0.0 113.038 -173.92 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 89.5 mt -92.46 18.95 7.74 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 124.432 1.093 . . . . 0.0 112.146 176.016 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 36.0 p90 -124.33 158.49 32.49 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 126.517 1.927 . . . . 0.0 111.005 -177.715 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -87.08 128.43 35.1 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.791 -0.568 . . . . 0.0 111.175 172.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -61.51 -20.72 63.52 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 172.059 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -81.78 -36.56 28.32 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.055 0.942 . . . . 0.0 111.291 -177.498 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -148.24 85.02 1.51 Allowed 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 127.321 2.248 . . . . 0.0 109.867 -173.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 28.3 mp0 -62.5 -15.64 51.28 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -172.321 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 27.3 p80 -65.88 -23.74 66.71 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 172.779 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.2 tpt -81.77 128.66 34.23 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.536 1.534 . . . . 0.0 110.758 175.186 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 3.9 t -126.16 112.39 29.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 C-N-CA 125.48 1.512 . . . . 0.0 109.4 179.306 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 35.9 t80 -95.46 52.25 1.37 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.875 1.27 . . . . 0.0 112.09 -170.181 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 55.6 m -69.69 -5.39 24.65 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 179.426 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.63 -25.12 58.04 Favored Glycine 0 CA--C 1.541 1.704 0 CA-C-N 120.116 1.326 . . . . 0.0 113.524 169.416 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -88.81 2.83 84.66 Favored Glycine 0 CA--C 1.542 1.728 0 C-N-CA 125.392 1.472 . . . . 0.0 115.295 171.54 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -108.93 172.99 6.52 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.174 1.79 . . . . 0.0 112.552 -177.516 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.8 tp -46.57 -43.05 16.84 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 126.809 2.044 . . . . 0.0 112.11 169.31 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 67.4 mt -54.79 -43.14 72.6 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-O 122.113 0.959 . . . . 0.0 112.159 173.434 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -74.64 -32.24 57.63 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 125.95 1.738 . . . . 0.0 114.412 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -67.25 -42.66 83.57 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 120.109 1.955 . . . . 0.0 110.374 169.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 24.9 tp -59.64 -50.95 71.88 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.413 1.485 . . . . 0.0 111.903 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -96.58 -13.8 22.67 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 -178.591 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.77 -18.24 12.85 Favored Glycine 0 CA--C 1.541 1.688 0 C-N-CA 125.641 1.591 . . . . 0.0 115.825 -178.772 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.41 17.99 1.52 Allowed 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 115.934 1.827 . . . . 0.0 115.934 -176.697 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.7 tp60 -68.05 40.73 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.045 0 N-CA-C 118.011 2.597 . . . . 0.0 118.011 -167.303 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 72.4 m -97.71 144.01 27.78 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 120.419 -1.426 . . . . 0.0 109.202 168.556 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 55.0 p90 -159.5 162.98 35.62 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -169.016 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 13.8 m -125.43 136.55 53.51 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.394 1.078 . . . . 0.0 110.679 177.87 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 20.1 m -77.42 -11.38 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -170.513 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -78.04 -13.88 59.71 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.875 1.27 . . . . 0.0 113.498 178.017 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -120.56 81.22 31.64 Favored Pre-proline 0 CA--C 1.547 0.86 0 C-N-CA 127.916 2.486 . . . . 0.0 108.874 179.842 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.18 -27.51 16.67 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 123.502 2.801 . . . . 0.0 114.739 -169.937 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 45.6 m -57.28 -51.06 84.54 Favored Pre-proline 0 N--CA 1.478 0.938 0 CA-C-N 120.342 1.428 . . . . 0.0 114.21 -178.823 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -67.49 -27.45 39.5 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 121.901 1.734 . . . . 0.0 113.38 175.088 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 21.8 tp -68.81 -42.45 77.26 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.292 1.037 . . . . 0.0 110.957 174.114 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -61.55 -33.79 74.45 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 118.126 -0.94 . . . . 0.0 112.675 172.395 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -62.96 -47.07 84.77 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 120.408 1.458 . . . . 0.0 112.377 176.384 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.432 ' HB2' ' HE2' ' A' ' 101' ' ' MET . 5.7 mtm -58.78 -47.43 84.75 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.023 0.929 . . . . 0.0 111.631 172.488 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.8 mp -67.06 -38.75 86.36 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 118.033 -0.984 . . . . 0.0 112.305 -179.109 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 7.6 mpt_? -56.04 -24.99 42.98 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-N 120.539 1.518 . . . . 0.0 113.345 171.186 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -93.07 -13.62 28.35 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.057 1.743 . . . . 0.0 114.076 176.188 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 21.6 t30 -131.89 -20.06 2.54 Favored 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 116.579 2.066 . . . . 0.0 116.579 -173.15 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 48.3 tp . . . . . 0 CA--C 1.547 0.838 0 C-N-CA 126.498 1.919 . . . . 0.0 114.693 -169.079 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 18.9 m . . . . . 0 N--CA 1.481 1.103 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.3 ttp180 -90.76 130.21 41.73 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 124.876 1.27 . . . . 0.0 112.258 -174.341 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -70.38 176.51 7.14 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 124.09 3.194 . . . . 0.0 112.872 169.842 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -58.8 144.17 44.93 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.871 0.868 . . . . 0.0 109.786 173.283 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 86.1 mt -63.43 -38.6 41.2 Favored Pre-proline 0 N--CA 1.476 0.856 0 N-CA-C 114.697 1.369 . . . . 0.0 114.697 -169.294 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -62.98 -33.34 74.75 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 121.686 1.591 . . . . 0.0 113.217 170.683 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 8.8 tt -68.97 -45.19 71.29 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.387 0.994 . . . . 0.0 111.048 176.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.4 tt -52.33 -38.99 60.07 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.97 0.908 . . . . 0.0 111.333 169.724 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.59 -28.06 68.86 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.893 1.071 . . . . 0.0 113.893 176.44 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 65.2 mt -68.63 -40.41 81.73 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 CA-C-N 119.362 0.983 . . . . 0.0 110.648 171.122 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.7 mp -64.96 -37.6 88.17 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.144 -0.972 . . . . 0.0 111.005 173.658 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 17.9 m170 -64.09 -40.01 95.3 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.63 -0.669 . . . . 0.0 111.771 172.768 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.87 -29.34 70.54 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.991 0.917 . . . . 0.0 113.01 173.87 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.404 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -73.28 -2.49 22.19 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.227 1.011 . . . . 0.0 113.488 171.334 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.93 7.31 64.47 Favored Glycine 0 CA--C 1.536 1.361 0 C-N-CA 125.729 1.633 . . . . 0.0 114.978 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -106.56 109.45 21.37 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 118.777 1.289 . . . . 0.0 112.282 -175.876 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.8 tm0? -69.84 141.82 53.18 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.22 0.608 . . . . 0.0 110.149 170.147 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 172.01 168.17 33.13 Favored Glycine 0 N--CA 1.466 0.695 0 C-N-CA 123.595 0.617 . . . . 0.0 114.478 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -128.08 -57.91 1.23 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.389 1.476 . . . . 0.0 111.293 179.18 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 24.0 mtm -106.06 125.71 51.32 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.846 1.658 . . . . 0.0 111.876 -177.26 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -139.21 145.23 39.02 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.256 1.022 . . . . 0.0 113.417 -173.507 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 52.9 p -88.38 174.66 8.02 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 125.482 1.513 . . . . 0.0 111.848 169.663 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 2.6 t -56.25 -46.03 81.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 120.441 -1.412 . . . . 0.0 109.837 168.946 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 63.4 tttm -58.75 -40.49 84.0 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.871 0.868 . . . . 0.0 112.423 -179.154 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -74.98 -36.41 62.02 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 175.469 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 67.6 t -67.36 -58.35 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 CA-C-O 117.78 -1.105 . . . . 0.0 110.998 176.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 16.1 mmt -60.59 -30.53 69.87 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-N 120.744 1.611 . . . . 0.0 112.889 -173.475 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -54.49 -59.09 5.15 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.704 173.323 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -74.72 -32.85 62.25 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 175.631 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.85 -40.67 60.87 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 120.801 -1.187 . . . . 0.0 112.043 -177.328 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.48 -40.69 99.05 Favored Glycine 0 CA--C 1.529 0.913 0 N-CA-C 111.604 -0.598 . . . . 0.0 111.604 171.494 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.8 tp60 -60.65 -45.01 95.71 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.13 0.972 . . . . 0.0 112.07 171.338 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.404 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 46.4 t80 -60.42 -51.6 68.81 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.347 1.059 . . . . 0.0 110.488 176.944 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 45.8 mt -61.58 -37.58 78.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 C-N-CA 124.024 0.929 . . . . 0.0 110.626 179.401 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -67.5 -42.28 83.1 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 119.425 1.011 . . . . 0.0 113.292 175.749 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.8 p -78.54 -30.08 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -177.218 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 21.9 mmtp -97.2 -12.4 23.07 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 125.112 1.365 . . . . 0.0 113.889 177.067 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.0 mp0 51.82 78.4 0.12 Allowed 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 126.95 2.1 . . . . 0.0 114.343 -176.061 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.6 tp -95.11 2.12 55.07 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.403 1.081 . . . . 0.0 112.884 177.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -102.04 162.17 13.12 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 127.627 2.371 . . . . 0.0 110.981 174.412 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -92.34 132.63 36.57 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 168.944 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.98 -29.02 64.91 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.165 0.893 . . . . 0.0 113.101 -176.627 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -78.34 -25.59 46.46 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.466 1.106 . . . . 0.0 111.862 -174.567 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -143.96 63.7 1.33 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 127.411 2.284 . . . . 0.0 110.127 -169.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -60.55 -20.0 59.03 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.823 0.849 . . . . 0.0 113.178 179.314 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 6.1 p-80 -66.28 -7.4 18.41 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.195 1.398 . . . . 0.0 113.867 169.411 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.6 ttm -124.95 143.48 50.86 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.438 1.895 . . . . 0.0 111.846 174.752 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.0 t -129.17 141.31 46.93 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 126.535 1.934 . . . . 0.0 108.878 -174.654 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -122.85 71.34 1.04 Allowed 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.582 1.153 . . . . 0.0 111.394 -171.336 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 3.5 m -87.71 8.1 27.08 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.185 1.18 . . . . 0.0 114.185 -173.092 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.42 -27.38 63.22 Favored Glycine 0 CA--C 1.54 1.6 0 O-C-N 120.852 -1.155 . . . . 0.0 114.64 179.009 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -89.43 3.89 83.91 Favored Glycine 0 CA--C 1.54 1.617 0 C-N-CA 125.186 1.374 . . . . 0.0 115.172 172.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -109.28 173.22 6.42 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.97 1.708 . . . . 0.0 112.508 -175.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.1 mp -53.17 -32.93 50.37 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.765 1.626 . . . . 0.0 113.041 169.88 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 95.8 mt -61.08 -47.51 85.99 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.102 -0.999 . . . . 0.0 111.397 170.672 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -63.61 -38.28 96.02 Favored Glycine 0 CA--C 1.531 1.053 0 CA-C-O 119.064 -0.853 . . . . 0.0 113.031 173.691 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.16 -29.24 62.71 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 119.903 1.851 . . . . 0.0 112.951 179.676 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.4 pp -80.66 -35.19 34.17 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 175.185 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.08 -7.49 23.16 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 119.266 0.939 . . . . 0.0 113.517 -177.817 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.08 -27.04 3.16 Favored Glycine 0 CA--C 1.541 1.659 0 O-C-N 120.164 -1.585 . . . . 0.0 113.35 -169.635 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.27 137.47 7.12 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 128.092 2.557 . . . . 0.0 110.789 177.831 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -144.75 56.36 1.27 Allowed 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 119.003 0.82 . . . . 0.0 110.608 169.331 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 6.7 m -102.78 129.24 49.37 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 168.445 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 52.3 p90 -163.4 173.8 12.75 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.693 1.197 . . . . 0.0 112.857 -168.057 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 52.9 p -119.97 146.14 46.11 Favored 'General case' 0 C--N 1.333 -0.139 0 C-N-CA 123.87 0.868 . . . . 0.0 112.984 172.602 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 14.4 m -77.68 -14.02 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 C-N-CA 123.157 0.583 . . . . 0.0 112.435 169.562 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 22.6 ttpp -64.73 -28.61 69.7 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.357 1.863 . . . . 0.0 112.598 169.894 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -117.55 77.47 10.72 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 126.46 1.904 . . . . 0.0 110.003 177.044 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -69.78 -24.78 29.18 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 123.613 2.875 . . . . 0.0 115.023 -169.742 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 48.8 m -60.4 -52.75 70.73 Favored Pre-proline 0 N--CA 1.477 0.886 0 CA-C-N 120.11 1.323 . . . . 0.0 114.124 -177.993 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -64.54 -32.33 59.18 Favored 'Trans proline' 0 CA--C 1.539 0.765 0 C-N-CA 122.109 1.872 . . . . 0.0 113.081 175.621 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 19.6 tp -65.38 -43.39 90.86 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 121.247 -0.908 . . . . 0.0 111.046 173.678 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -63.85 -37.4 87.26 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.745 0.818 . . . . 0.0 112.223 174.642 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -62.71 -47.51 83.28 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.836 0.854 . . . . 0.0 112.655 174.419 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.445 ' HB2' ' HE3' ' A' ' 101' ' ' MET . 32.0 mtm -58.99 -46.72 87.44 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.211 0.604 . . . . 0.0 112.223 171.868 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 59.0 mt -58.55 -47.18 85.07 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.064 0.946 . . . . 0.0 111.821 177.065 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 34.9 mtp180 -54.46 -25.11 23.22 Favored 'General case' 0 N--CA 1.482 1.168 0 CA-C-N 119.768 1.167 . . . . 0.0 113.535 173.059 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -91.55 -15.41 28.74 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 126.259 1.823 . . . . 0.0 114.655 176.331 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 14.6 p30 -116.29 -23.14 8.5 Favored 'General case' 0 N--CA 1.483 1.225 0 CA-C-N 120.485 1.493 . . . . 0.0 114.587 179.372 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 30.0 tp . . . . . 0 CA--C 1.537 0.45 0 C-N-CA 128.405 2.682 . . . . 0.0 106.101 169.624 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 31.7 m . . . . . 0 N--CA 1.482 1.138 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 95.4 mtm-85 -86.18 149.42 49.88 Favored Pre-proline 0 N--CA 1.48 1.037 0 O-C-N 121.004 -1.06 . . . . 0.0 111.217 -177.658 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -73.19 174.65 11.71 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 123.155 2.57 . . . . 0.0 111.823 169.776 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt -62.94 148.46 47.4 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.406 1.082 . . . . 0.0 110.054 177.112 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 94.0 mt -55.74 -46.73 99.7 Favored Pre-proline 0 N--CA 1.476 0.832 0 N-CA-C 115.24 1.57 . . . . 0.0 115.24 -168.057 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -66.4 -23.54 50.95 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 CA-C-N 122.509 1.932 . . . . 0.0 114.247 175.599 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.3 tt -71.78 -39.97 69.57 Favored 'General case' 0 N--CA 1.474 0.725 0 O-C-N 120.85 -1.156 . . . . 0.0 109.932 170.01 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 13.6 tp -61.58 -34.58 75.86 Favored 'General case' 0 CA--C 1.548 0.895 0 O-C-N 121.12 -0.987 . . . . 0.0 111.665 170.732 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.419 ' HA ' ' HE2' ' A' ' 35' ' ' LYS . 8.5 mmpt? -65.43 -39.34 91.97 Favored 'General case' 0 N--CA 1.481 1.095 0 O-C-N 121.147 -0.971 . . . . 0.0 112.649 170.012 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 52.6 mt -63.57 -38.88 83.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 124.401 1.08 . . . . 0.0 111.844 172.686 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.9 mt -61.52 -41.04 96.72 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 121.058 -1.026 . . . . 0.0 112.235 169.543 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 49.4 m170 -64.68 -41.93 95.7 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 121.494 -0.754 . . . . 0.0 112.209 172.662 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.91 -25.0 67.7 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.774 1.23 . . . . 0.0 113.331 177.457 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.424 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -71.44 -6.5 40.84 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.904 0.881 . . . . 0.0 113.313 171.684 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.03 12.73 59.9 Favored Glycine 0 CA--C 1.536 1.388 0 C-N-CA 125.177 1.37 . . . . 0.0 114.453 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -108.92 163.16 13.53 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.533 1.533 . . . . 0.0 112.813 -178.198 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -79.99 172.54 13.63 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 121.63 -0.669 . . . . 0.0 110.934 168.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -153.44 102.44 0.22 Allowed Glycine 0 N--CA 1.469 0.841 0 O-C-N 121.373 -0.829 . . . . 0.0 114.252 177.52 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -150.12 85.62 1.41 Allowed 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 126.805 2.042 . . . . 0.0 107.384 170.649 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.1 mpp? 67.22 135.46 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 131.49 3.916 . . . . 0.0 116.256 176.751 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -161.76 169.34 21.59 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.138 1.375 . . . . 0.0 112.788 177.309 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 82.1 p -91.09 171.65 9.11 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 126.55 1.94 . . . . 0.0 111.954 172.871 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -51.19 -42.23 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.317 0 O-C-N 121.288 -0.883 . . . . 0.0 111.537 172.785 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -62.57 -48.19 80.53 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.367 1.067 . . . . 0.0 112.544 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -73.64 -31.56 63.57 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -178.475 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 57.9 t -64.91 -46.31 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 O-C-N 121.615 -0.678 . . . . 0.0 110.647 169.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.9 ttm -69.29 -32.67 71.98 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 126.2 1.8 . . . . 0.0 114.114 -177.345 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -51.48 -49.7 61.3 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 122.974 0.51 . . . . 0.0 111.137 169.971 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 42.3 m-85 -74.71 -36.7 62.69 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 115.04 1.496 . . . . 0.0 115.04 171.76 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.1 mp -71.77 -36.95 70.52 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 120.87 1.668 . . . . 0.0 113.435 -177.42 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.13 -42.1 99.56 Favored Glycine 0 CA--C 1.533 1.18 0 CA-C-N 119.246 0.93 . . . . 0.0 111.688 170.516 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.9 tp60 -62.14 -42.69 99.5 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.644 1.178 . . . . 0.0 112.317 172.794 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.424 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 50.4 t80 -62.17 -52.34 64.2 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.743 1.217 . . . . 0.0 110.2 176.432 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 69.0 mt -58.68 -39.61 76.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 C-N-CA 123.954 0.902 . . . . 0.0 110.752 178.692 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.3 tpt -65.8 -44.19 86.41 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.351 1.06 . . . . 0.0 112.902 175.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.0 p -78.49 -27.77 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 CA-C-N 119.809 1.186 . . . . 0.0 113.399 -177.472 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 54.4 mmtt -89.73 -15.74 31.83 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.108 1.363 . . . . 0.0 113.268 173.601 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 13.9 mp0 51.86 57.88 6.05 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.815 2.046 . . . . 0.0 112.268 -171.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 13.8 tp -91.88 0.93 57.46 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.393 1.077 . . . . 0.0 112.533 -174.733 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 41.5 p90 -92.62 156.43 17.1 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.854 1.662 . . . . 0.0 111.177 171.797 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -80.41 122.71 27.3 Favored 'General case' 0 CA--C 1.541 0.634 0 O-C-N 121.579 -0.7 . . . . 0.0 110.86 172.411 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -59.53 -23.85 63.18 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 114.683 1.364 . . . . 0.0 114.683 177.842 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -91.35 -27.81 18.12 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 123.96 0.904 . . . . 0.0 112.154 -173.443 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -147.03 87.73 1.7 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.844 2.457 . . . . 0.0 109.605 178.328 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 29.6 mp0 -64.43 -12.03 39.22 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 -169.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 28.1 p80 -65.66 -24.79 67.11 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 170.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 20.6 tpp -86.14 132.02 34.12 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.239 1.416 . . . . 0.0 111.629 177.382 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 3.7 t -127.09 125.71 66.85 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 C-N-CA 127.01 2.124 . . . . 0.0 109.49 178.477 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 23.2 t80 -101.14 46.84 0.93 Allowed 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.64 1.176 . . . . 0.0 113.244 -169.626 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 85.2 m -64.88 -9.65 22.58 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 120.467 -1.396 . . . . 0.0 113.848 -179.507 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -54.98 -22.79 29.13 Favored Glycine 0 CA--C 1.541 1.687 0 C-N-CA 124.78 1.181 . . . . 0.0 113.776 169.551 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -86.72 1.98 87.15 Favored Glycine 0 CA--C 1.541 1.71 0 C-N-CA 125.228 1.394 . . . . 0.0 116.148 173.904 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -131.69 -173.62 3.18 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 120.1 1.95 . . . . 0.0 113.769 -175.217 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 7.5 mp -47.15 -40.52 15.89 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.949 1.699 . . . . 0.0 113.532 179.081 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.5 tp -68.57 -32.4 72.29 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-O 121.617 0.722 . . . . 0.0 111.256 178.625 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -73.15 -36.0 56.74 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 126.64 2.067 . . . . 0.0 114.51 173.442 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -66.37 -42.36 88.09 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.861 1.83 . . . . 0.0 110.161 170.857 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 27.7 tp -59.25 -51.45 69.93 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.677 1.191 . . . . 0.0 112.332 178.525 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.22 -10.98 26.74 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 114.91 1.448 . . . . 0.0 114.91 -177.303 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.0 -20.04 7.06 Favored Glycine 0 CA--C 1.539 1.584 0 C-N-CA 125.931 1.729 . . . . 0.0 115.638 -179.496 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.09 30.57 0.49 Allowed 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -175.207 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 5.6 tp60 -70.45 44.79 0.08 Allowed 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 116.4 2.0 . . . . 0.0 116.4 -168.409 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 21.2 m -105.61 138.36 41.94 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 120.778 -1.201 . . . . 0.0 108.973 169.378 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 45.7 p90 -157.24 167.94 28.87 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 -167.528 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 50.1 m -115.09 136.02 53.57 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 113.936 -1.484 . . . . 0.0 109.841 175.3 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 24.4 m -77.53 -20.05 14.05 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.344 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -178.823 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -74.8 -6.25 47.94 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 126.484 1.913 . . . . 0.0 115.171 -178.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -121.16 87.89 44.66 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 126.439 1.896 . . . . 0.0 109.476 -177.545 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -63.33 -31.34 73.35 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 123.93 3.086 . . . . 0.0 115.273 -169.866 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 70.0 m -61.5 -55.91 38.34 Favored Pre-proline 0 N--CA 1.477 0.89 0 CA-C-N 120.12 1.327 . . . . 0.0 113.825 -177.248 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -67.17 -27.17 41.81 Favored 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 121.817 1.678 . . . . 0.0 112.63 175.219 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 27.9 tp -65.55 -45.93 81.5 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.634 0.774 . . . . 0.0 111.158 175.993 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -63.48 -36.33 83.4 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.627 -0.671 . . . . 0.0 112.564 173.129 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -59.92 -46.3 89.8 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 119.355 0.98 . . . . 0.0 112.079 176.935 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.403 ' HE3' ' HB2' ' A' ' 101' ' ' MET . 29.0 mtm -62.09 -49.86 74.25 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 171.637 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -64.94 -46.76 80.23 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 118.042 -0.98 . . . . 0.0 111.053 -171.569 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -58.19 -23.6 56.11 Favored 'General case' 0 N--CA 1.482 1.14 0 CA-C-N 119.975 1.261 . . . . 0.0 113.338 175.822 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -90.49 -18.74 24.78 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.968 1.707 . . . . 0.0 114.806 174.842 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -121.86 -26.68 4.78 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-N 119.843 1.201 . . . . 0.0 114.145 -171.856 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 3.3 tt . . . . . 0 CA--C 1.543 0.676 0 C-N-CA 127.631 2.373 . . . . 0.0 107.188 174.703 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 17.8 m . . . . . 0 N--CA 1.481 1.093 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 30.9 ttm105 -86.69 143.1 35.26 Favored Pre-proline 0 N--CA 1.48 1.075 0 C-N-CA 124.796 1.238 . . . . 0.0 112.56 -172.354 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -65.81 166.83 19.09 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 122.606 2.204 . . . . 0.0 111.953 168.33 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 27.8 ttpt -72.53 157.67 37.15 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 170.138 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.3 mp -50.4 -47.5 83.27 Favored Pre-proline 0 N--CA 1.473 0.696 0 N-CA-C 115.252 1.575 . . . . 0.0 115.252 -168.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_exo -66.19 -28.99 47.79 Favored 'Trans proline' 0 C--N 1.348 0.522 0 CA-C-N 121.689 1.639 . . . . 0.0 113.732 178.414 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.4 tt -74.11 -38.62 63.77 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.37 -0.831 . . . . 0.0 109.606 177.266 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 23.1 tp -60.2 -35.59 75.75 Favored 'General case' 0 CA--C 1.55 0.956 0 O-C-N 121.521 -0.737 . . . . 0.0 111.341 170.115 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.4 mmtp -69.62 -36.51 76.21 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 121.386 -0.821 . . . . 0.0 112.552 174.934 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.29 -38.65 81.66 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.495 0.718 . . . . 0.0 110.921 170.773 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.5 mp -64.13 -39.95 95.14 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.029 -1.045 . . . . 0.0 113.116 171.155 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 35.6 m170 -58.81 -47.32 85.17 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 119.592 1.087 . . . . 0.0 111.497 170.087 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.16 -25.15 68.22 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 177.098 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.469 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -67.62 -15.22 63.54 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.067 0.947 . . . . 0.0 113.322 172.958 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 89.47 12.59 62.68 Favored Glycine 0 CA--C 1.537 1.413 0 C-N-CA 125.06 1.314 . . . . 0.0 113.883 -169.956 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -98.67 157.5 16.22 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.893 1.277 . . . . 0.0 111.662 176.909 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.8 tp60 -80.38 164.42 23.11 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.658 0.783 . . . . 0.0 111.36 174.999 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -82.08 -156.78 18.86 Favored Glycine 0 CA--C 1.537 1.462 0 N-CA-C 115.809 1.084 . . . . 0.0 115.809 174.81 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 61.0 66.16 0.93 Allowed 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 127.611 2.364 . . . . 0.0 116.592 173.39 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . 0.401 0.9 OUTLIER 51.38 146.05 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.275 1 N-CA-C 121.967 4.062 . . . . 0.0 121.967 168.307 . . . . . . . . 4 3 . 1 . 013 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -157.53 172.15 19.08 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.559 1.543 . . . . 0.0 112.596 -168.416 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 40.0 p -81.66 168.78 17.77 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 124.475 1.11 . . . . 0.0 112.067 171.058 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -57.92 -41.06 79.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 120.22 -1.55 . . . . 0.0 110.663 172.406 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -59.42 -31.77 69.58 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.666 0.786 . . . . 0.0 112.709 178.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -80.55 -53.16 6.81 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.082 0.953 . . . . 0.0 112.903 170.508 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 88.5 t -56.08 -52.3 51.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 123.776 0.83 . . . . 0.0 111.275 -176.42 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 26.7 mmm -73.15 -30.64 63.73 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -172.399 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 54.9 t-80 -61.58 -48.24 81.83 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.583 170.708 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -64.54 -38.95 92.79 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 121.743 -0.598 . . . . 0.0 112.389 173.596 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.98 -38.78 92.11 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 121.187 -0.946 . . . . 0.0 111.448 175.055 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.74 -39.14 97.17 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 125.385 1.469 . . . . 0.0 112.885 172.812 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 11.9 tp60 -60.94 -48.64 80.87 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.757 1.223 . . . . 0.0 111.091 169.868 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.469 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 33.5 t80 -56.54 -48.96 76.17 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.122 -0.986 . . . . 0.0 110.735 174.218 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 47.0 mt -59.63 -36.76 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 125.228 1.411 . . . . 0.0 111.935 177.731 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.5 tpt -68.12 -36.5 79.84 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.718 1.207 . . . . 0.0 112.231 174.194 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 94.2 t -78.18 -33.41 17.84 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 124.063 0.945 . . . . 0.0 112.677 178.458 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 48.2 mmtt -89.84 -14.82 33.56 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.752 1.221 . . . . 0.0 113.222 178.016 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.6 mp0 50.02 63.94 1.99 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 127.627 2.371 . . . . 0.0 113.088 -171.866 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 14.3 tp -91.26 -1.59 57.64 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.149 0.98 . . . . 0.0 113.295 -175.903 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 55.1 p90 -90.25 156.22 18.45 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.551 1.54 . . . . 0.0 111.923 178.345 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -76.83 128.64 34.97 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.816 -0.553 . . . . 0.0 111.136 171.543 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.6 pm0 -69.68 -27.22 64.83 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 115.271 1.582 . . . . 0.0 115.271 -171.171 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -96.08 -26.92 15.32 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 119.165 0.893 . . . . 0.0 111.891 -177.315 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -136.19 79.75 1.79 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.669 1.988 . . . . 0.0 111.178 176.646 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 29.7 mp0 -60.89 -12.73 12.0 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -173.428 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 23.9 p80 -62.38 -25.76 68.1 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 118.94 0.791 . . . . 0.0 112.786 170.647 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 18.2 tpp -83.6 129.17 34.96 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.069 1.347 . . . . 0.0 110.955 172.754 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.4 t -119.01 117.57 54.73 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 125.991 1.716 . . . . 0.0 107.856 174.36 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -102.09 65.74 0.99 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.213 1.005 . . . . 0.0 112.165 -169.11 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 2.7 m -79.32 3.91 16.77 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 114.258 1.207 . . . . 0.0 114.258 -173.473 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.95 -26.08 54.48 Favored Glycine 0 CA--C 1.542 1.727 0 CA-C-N 119.927 1.24 . . . . 0.0 114.316 171.854 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -91.68 7.34 79.68 Favored Glycine 0 CA--C 1.542 1.738 0 C-N-CA 125.437 1.494 . . . . 0.0 115.374 172.734 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -112.74 170.31 8.28 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.181 1.792 . . . . 0.0 112.537 -174.13 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.9 tt -46.53 -43.17 16.72 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.63 1.572 . . . . 0.0 111.089 169.499 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 96.3 mt -55.13 -43.23 73.93 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.248 1.019 . . . . 0.0 112.522 173.912 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -70.64 -39.1 67.61 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 124.984 1.278 . . . . 0.0 113.62 177.275 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -63.52 -42.61 98.46 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 120.363 2.082 . . . . 0.0 110.696 174.074 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 40.2 tp -62.7 -51.59 66.6 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.976 1.711 . . . . 0.0 112.52 -178.477 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -97.26 -8.48 29.73 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 -176.251 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 82.69 -24.68 4.94 Favored Glycine 0 CA--C 1.54 1.613 0 C-N-CA 125.492 1.52 . . . . 0.0 113.126 -169.698 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.18 137.21 10.39 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 127.049 2.14 . . . . 0.0 111.611 175.588 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -148.44 45.1 1.04 Allowed 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.153 0.981 . . . . 0.0 110.161 169.05 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 11.5 m -99.51 131.17 45.69 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 120.933 -1.104 . . . . 0.0 110.368 170.115 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 35.7 p90 -165.16 178.78 6.74 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.589 1.555 . . . . 0.0 111.98 -168.632 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 77.3 p -127.21 143.88 51.16 Favored 'General case' 0 N--CA 1.456 -0.162 0 N-CA-C 114.63 1.345 . . . . 0.0 114.63 174.157 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.3 m -72.1 -16.84 18.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 N-CA-C 114.042 1.127 . . . . 0.0 114.042 -173.792 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.5 pttt -74.43 -9.49 58.64 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.854 1.662 . . . . 0.0 114.108 172.566 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -121.09 79.84 34.59 Favored Pre-proline 0 CA--C 1.549 0.906 0 C-N-CA 126.091 1.757 . . . . 0.0 110.154 -179.036 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.14 -28.52 28.11 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 123.449 2.766 . . . . 0.0 114.712 -169.951 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 59.2 m -57.51 -54.14 58.17 Favored Pre-proline 0 N--CA 1.477 0.882 0 CA-C-N 120.147 1.339 . . . . 0.0 113.721 -177.775 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -66.16 -27.26 49.17 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 121.889 1.726 . . . . 0.0 112.854 174.323 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.21 -53.41 57.31 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.255 1.022 . . . . 0.0 110.568 175.295 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -63.77 -32.45 73.96 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.72 0.808 . . . . 0.0 112.52 173.616 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -62.47 -43.85 97.81 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 120.123 1.329 . . . . 0.0 112.844 175.116 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 23.5 mtm -63.5 -49.67 72.64 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.023 0.529 . . . . 0.0 111.729 171.475 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.8 mp -62.43 -36.78 83.46 Favored 'General case' 0 C--O 1.219 -0.547 0 CA-C-O 117.696 -1.145 . . . . 0.0 111.808 -177.954 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 -55.1 -24.49 25.9 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 121.336 1.88 . . . . 0.0 113.662 171.804 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -89.99 -15.08 32.65 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 125.367 1.467 . . . . 0.0 114.559 173.071 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -132.37 2.69 3.88 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 115.595 1.702 . . . . 0.0 115.595 -177.528 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 62.0 tp . . . . . 0 CA--C 1.54 0.577 0 C-N-CA 128.251 2.62 . . . . 0.0 108.573 -178.705 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.6 m . . . . . 0 N--CA 1.48 1.033 0 CA-C-O 121.173 0.511 . . . . 0.0 111.84 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -81.8 140.91 47.34 Favored Pre-proline 0 N--CA 1.481 1.121 0 C-N-CA 124.547 1.139 . . . . 0.0 112.941 -169.131 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -70.28 175.6 8.31 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 123.793 2.995 . . . . 0.0 113.791 175.003 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 17.3 ttmt -60.56 147.27 42.14 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.564 1.145 . . . . 0.0 109.617 172.253 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 73.6 mt -57.12 -47.05 99.73 Favored Pre-proline 0 N--CA 1.474 0.744 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 -167.902 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -66.82 -23.63 47.71 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 CA-C-N 121.8 1.679 . . . . 0.0 114.609 176.9 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.409 ' C ' HD23 ' A' ' 33' ' ' LEU . 5.6 tt -65.92 -44.11 86.12 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 120.057 1.299 . . . . 0.0 109.31 172.61 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 36.6 tp -62.13 -39.99 94.42 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 121.738 -0.601 . . . . 0.0 111.729 172.853 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.8 mmpt? -61.28 -39.81 91.81 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.339 0.655 . . . . 0.0 112.698 174.04 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 63.5 mt -64.33 -35.56 74.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 124.355 1.062 . . . . 0.0 112.224 174.402 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.1 mt -70.65 -34.87 72.51 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 119.666 1.121 . . . . 0.0 111.944 171.932 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 50.9 m170 -61.19 -42.32 98.36 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.053 0.842 . . . . 0.0 111.275 169.48 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.66 -24.86 67.72 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.512 1.125 . . . . 0.0 113.513 175.023 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.458 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -71.51 -7.02 44.91 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 124.155 0.982 . . . . 0.0 113.141 171.284 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 85.49 12.78 71.92 Favored Glycine 0 CA--C 1.537 1.421 0 C-N-CA 125.205 1.383 . . . . 0.0 114.146 -173.995 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -106.3 140.9 38.51 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.955 1.302 . . . . 0.0 112.637 -176.379 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -76.66 162.55 27.64 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 121.721 -0.612 . . . . 0.0 110.479 169.036 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -162.99 130.42 2.24 Favored Glycine 0 CA--C 1.526 0.747 0 O-C-N 121.432 -0.792 . . . . 0.0 114.982 -178.854 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -142.17 66.68 1.33 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 126.227 1.811 . . . . 0.0 109.162 173.276 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . 0.419 0.6 OUTLIER 63.38 145.86 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 129.537 3.135 . . . . 0.0 118.191 -175.013 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -162.72 169.55 19.81 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.089 1.756 . . . . 0.0 113.07 -168.745 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 41.8 p -79.96 171.37 15.19 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 125.244 1.418 . . . . 0.0 112.01 169.5 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -59.52 -39.19 78.68 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 O-C-N 120.549 -1.345 . . . . 0.0 111.676 173.736 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -62.18 -45.57 92.82 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.272 1.429 . . . . 0.0 112.724 176.364 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -68.76 -38.88 80.42 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.259 0.624 . . . . 0.0 112.176 176.677 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 8.5 t -58.37 -45.3 89.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 124.689 1.196 . . . . 0.0 111.126 170.177 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -69.3 -33.97 73.98 Favored 'General case' 0 CA--C 1.519 -0.242 0 C-N-CA 126.942 2.097 . . . . 0.0 114.512 -172.425 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -51.56 -49.29 62.32 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 120.699 0.285 . . . . 0.0 111.149 169.932 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -74.77 -32.26 62.01 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 172.207 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.91 -40.79 78.89 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 120.431 1.469 . . . . 0.0 112.43 178.873 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -60.18 -45.62 95.71 Favored Glycine 0 CA--C 1.529 0.919 0 N-CA-C 111.269 -0.732 . . . . 0.0 111.269 171.524 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 11.0 tp60 -58.32 -42.61 87.12 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.269 1.028 . . . . 0.0 112.582 173.294 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.458 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 56.3 t80 -61.13 -50.12 74.48 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.078 0.951 . . . . 0.0 110.544 174.843 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 72.4 mt -61.44 -37.13 77.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 123.781 0.833 . . . . 0.0 111.154 178.943 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 34.3 mmt -67.58 -42.97 81.65 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 119.502 1.046 . . . . 0.0 113.256 174.183 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.3 p -78.49 -27.42 14.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 CA-C-N 119.738 1.154 . . . . 0.0 113.267 -176.76 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 56.4 mmtt -93.24 -15.69 25.6 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.266 1.427 . . . . 0.0 113.566 174.134 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 14.8 mp0 54.36 61.29 3.09 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.68 1.992 . . . . 0.0 113.022 -175.493 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.2 tp -94.4 10.12 35.6 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.48 1.112 . . . . 0.0 112.873 -176.415 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 25.1 p90 -113.26 155.43 25.1 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 127.128 2.171 . . . . 0.0 111.49 -178.548 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -80.96 129.64 34.63 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 122.048 -0.408 . . . . 0.0 110.174 169.802 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 7.7 pm0 -59.02 -33.88 71.24 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -173.827 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -108.02 -27.88 9.88 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.498 1.119 . . . . 0.0 112.185 -171.406 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -109.14 56.5 0.62 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.763 2.025 . . . . 0.0 111.019 171.957 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -60.71 -18.63 55.43 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 124.494 1.118 . . . . 0.0 113.434 -175.387 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 29.6 p80 -63.26 -14.8 53.56 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.584 1.154 . . . . 0.0 114.013 171.367 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 13.8 ttm -111.64 141.72 44.87 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.007 1.323 . . . . 0.0 112.132 172.063 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.5 t -122.99 133.3 69.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 126.258 1.823 . . . . 0.0 108.821 175.853 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 6.6 t80 -113.32 52.07 0.81 Allowed 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.77 0.795 . . . . 0.0 112.968 -169.529 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 4.9 m -71.52 -6.37 40.12 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 -175.714 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -55.54 -25.54 42.69 Favored Glycine 0 CA--C 1.541 1.657 0 C-N-CA 125.439 1.495 . . . . 0.0 115.148 177.165 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -88.47 0.24 82.95 Favored Glycine 0 CA--C 1.541 1.658 0 C-N-CA 125.051 1.31 . . . . 0.0 115.601 175.246 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -131.92 -176.07 3.93 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 126.067 1.747 . . . . 0.0 112.072 -171.426 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -46.71 -47.05 20.55 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.833 2.053 . . . . 0.0 113.871 -170.806 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 94.0 mt -60.08 -37.81 81.03 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.81 1.244 . . . . 0.0 112.564 175.162 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -73.16 -34.24 58.42 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 125.697 1.617 . . . . 0.0 114.311 175.611 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -66.51 -42.39 87.42 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 119.68 1.74 . . . . 0.0 110.444 171.353 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 32.9 tp -61.53 -50.77 71.33 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.401 1.48 . . . . 0.0 112.524 179.049 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -99.02 -14.27 19.53 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 115.154 1.538 . . . . 0.0 115.154 -175.442 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 82.35 -19.1 11.37 Favored Glycine 0 CA--C 1.541 1.665 0 C-N-CA 125.729 1.633 . . . . 0.0 116.114 179.448 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.0 24.12 1.18 Allowed 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 -176.794 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -71.26 52.65 0.18 Allowed 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 117.533 2.42 . . . . 0.0 117.533 -167.492 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 36.0 m -117.79 139.06 51.6 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.235 1.014 . . . . 0.0 108.53 168.756 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 45.8 p90 -159.34 167.12 29.66 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -167.245 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 2.1 m -99.91 136.29 40.05 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.608 1.563 . . . . 0.0 110.328 169.633 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 6.9 m -77.6 -19.87 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 124.399 1.079 . . . . 0.0 112.803 175.039 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 61.3 pttt -80.56 -2.94 48.38 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 127.592 2.357 . . . . 0.0 115.114 -179.256 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ASP . . . . . 0.401 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 48.9 t0 -125.94 94.26 42.17 Favored Pre-proline 0 CA--C 1.549 0.92 0 C-N-CA 126.592 1.957 . . . . 0.0 110.267 -171.36 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 94' ' ' ASP . 20.3 Cg_endo -61.5 -31.39 87.66 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 123.936 3.091 . . . . 0.0 115.529 -174.799 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 66.8 m -58.53 -53.1 69.65 Favored Pre-proline 0 N--CA 1.477 0.882 0 CA-C-N 119.92 1.236 . . . . 0.0 114.057 -178.097 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -68.39 -24.33 36.99 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 122.034 1.823 . . . . 0.0 113.49 174.692 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 61.5 mt -65.9 -47.08 75.99 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 119.522 1.055 . . . . 0.0 111.058 174.381 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -58.13 -41.3 83.36 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 178.233 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -58.74 -51.72 68.77 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 118.963 0.801 . . . . 0.0 112.487 176.828 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 34.0 mtm -64.16 -49.69 71.09 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.266 0.626 . . . . 0.0 112.287 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.4 mp -63.61 -49.38 73.54 Favored 'General case' 0 C--O 1.224 -0.263 0 C-N-CA 124.568 1.147 . . . . 0.0 110.756 -176.682 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -60.32 -19.21 54.39 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 120.238 1.381 . . . . 0.0 113.647 178.679 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -96.74 -14.14 22.21 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.948 1.699 . . . . 0.0 114.435 175.126 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -118.23 -21.39 8.19 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-N 120.047 1.294 . . . . 0.0 113.742 -178.439 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 43.8 tp . . . . . 0 CA--C 1.536 0.439 0 C-N-CA 127.225 2.21 . . . . 0.0 107.787 169.26 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 35.0 m . . . . . 0 N--CA 1.477 0.914 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 37.6 mtm180 -91.39 145.25 31.04 Favored Pre-proline 0 N--CA 1.479 1.01 0 C-N-CA 124.405 1.082 . . . . 0.0 112.482 -175.255 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -75.78 177.92 8.09 Favored 'Trans proline' 0 CA--C 1.54 0.807 0 C-N-CA 124.152 3.235 . . . . 0.0 111.499 169.324 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.7 ttmt -69.24 148.53 49.68 Favored 'General case' 0 CA--C 1.536 0.442 0 O-C-N 121.638 -0.664 . . . . 0.0 111.237 178.414 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 10.0 mp -53.67 -55.17 38.17 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 125.133 1.373 . . . . 0.0 114.548 -169.236 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -65.46 -22.0 59.7 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 122.297 1.998 . . . . 0.0 113.845 175.755 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.0 tt -75.21 -32.41 61.18 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 119.88 1.218 . . . . 0.0 110.988 172.573 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.3 tp -63.69 -37.31 86.88 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.308 -0.87 . . . . 0.0 111.017 169.189 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.42 ' HA ' ' HE2' ' A' ' 35' ' ' LYS . 8.9 mmpt? -62.61 -37.62 86.96 Favored 'General case' 0 N--CA 1.479 0.998 0 O-C-N 121.674 -0.641 . . . . 0.0 112.34 173.241 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 90.4 mt -62.94 -39.0 83.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 124.067 0.947 . . . . 0.0 111.467 172.507 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.3 mp -70.35 -33.06 71.01 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 120.715 -1.241 . . . . 0.0 113.332 172.175 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 63.5 m170 -64.46 -41.36 96.56 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 120.957 -1.09 . . . . 0.0 111.401 170.388 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.28 -24.12 67.72 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.013 0.925 . . . . 0.0 113.323 172.424 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.488 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -72.09 -9.12 57.97 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 123.955 0.902 . . . . 0.0 113.425 172.158 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.51 7.75 64.75 Favored Glycine 0 CA--C 1.538 1.491 0 C-N-CA 125.4 1.476 . . . . 0.0 114.572 -175.181 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -94.08 166.54 12.08 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.67 1.188 . . . . 0.0 113.08 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.1 tm0? -126.53 144.53 50.84 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.839 1.656 . . . . 0.0 108.973 169.75 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -174.71 165.48 36.79 Favored Glycine 0 C--N 1.339 0.711 0 N-CA-C 116.496 1.358 . . . . 0.0 116.496 -170.416 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -141.26 -65.38 0.43 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.408 1.883 . . . . 0.0 109.18 169.846 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 25.9 mtm -106.29 142.76 35.43 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 127.811 2.445 . . . . 0.0 112.169 -178.069 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -157.4 162.95 39.03 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.062 0.945 . . . . 0.0 113.419 -173.714 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 81.2 p -94.97 172.85 7.9 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.613 1.165 . . . . 0.0 108.366 166.179 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -57.4 -46.88 85.62 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.426 0 O-C-N 120.082 -1.636 . . . . 0.0 109.817 169.45 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -55.97 -39.89 72.45 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.786 1.234 . . . . 0.0 112.649 -179.181 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -74.2 -37.29 63.93 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 175.588 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 97.0 t -68.71 -49.66 62.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 CA-C-N 119.946 1.248 . . . . 0.0 111.978 175.87 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 11.5 mmm -67.63 -28.05 67.4 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 119.229 0.922 . . . . 0.0 112.99 -170.914 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -53.44 -54.03 42.77 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 114.84 -1.073 . . . . 0.0 111.355 169.724 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -74.35 -35.22 63.57 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 176.826 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.32 -37.56 77.79 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 121.131 -0.98 . . . . 0.0 112.107 178.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -64.99 -42.82 96.6 Favored Glycine 0 CA--C 1.529 0.929 0 C-N-CA 124.588 1.09 . . . . 0.0 112.054 172.351 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 30.4 tp60 -57.94 -44.54 87.01 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.046 0.938 . . . . 0.0 111.641 169.903 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.488 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 70.9 t80 -60.86 -52.18 66.13 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.505 0.722 . . . . 0.0 111.304 176.257 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 25.8 mt -58.79 -36.83 62.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 124.376 1.07 . . . . 0.0 111.371 177.324 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.6 tpt -66.39 -45.04 81.38 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 125.206 1.402 . . . . 0.0 112.684 175.166 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.7 p -78.51 -27.28 14.14 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 CA-C-N 119.709 1.14 . . . . 0.0 113.488 -177.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 53.7 mmtt -90.97 -15.74 29.18 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 125.287 1.435 . . . . 0.0 113.494 173.898 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 16.0 mp0 54.69 63.94 1.98 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 127.412 2.285 . . . . 0.0 113.417 -175.749 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.7 mt -91.86 -8.13 47.38 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.59 0.756 . . . . 0.0 113.007 176.133 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 54.2 p90 -76.61 153.39 35.32 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.845 0.858 . . . . 0.0 111.072 170.028 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -82.82 130.81 35.18 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 121.719 -0.613 . . . . 0.0 110.828 171.392 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -64.11 -25.36 68.06 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 120.969 -1.082 . . . . 0.0 113.353 -177.73 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -91.69 -22.72 20.09 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 123.923 0.889 . . . . 0.0 111.671 -172.224 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -149.84 75.42 1.25 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 129.327 3.051 . . . . 0.0 109.662 -174.067 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 29.9 mp0 -60.7 -18.64 55.42 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -173.405 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 1.6 p-80 -63.7 -29.74 70.93 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 113.469 0.915 . . . . 0.0 113.469 169.926 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 16.9 tpp -81.35 130.01 34.86 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.515 1.126 . . . . 0.0 110.532 171.584 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.5 t -124.81 117.38 50.1 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 C-N-CA 126.099 1.76 . . . . 0.0 108.664 177.8 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -96.77 73.53 2.65 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.165 1.386 . . . . 0.0 110.713 -177.163 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 72.5 m -76.76 -0.81 25.16 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 121.208 -0.932 . . . . 0.0 112.944 171.852 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.58 -25.63 58.62 Favored Glycine 0 CA--C 1.541 1.685 0 O-C-N 120.557 -1.34 . . . . 0.0 113.879 169.637 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -87.56 3.77 86.19 Favored Glycine 0 CA--C 1.542 1.731 0 C-N-CA 125.32 1.438 . . . . 0.0 115.224 171.312 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -107.57 167.51 9.9 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 126.231 1.812 . . . . 0.0 112.438 -176.372 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.9 tp -46.61 -43.0 17.0 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.184 1.794 . . . . 0.0 111.917 169.152 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 13.9 tp -59.38 -41.35 89.15 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.412 1.485 . . . . 0.0 111.74 175.983 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -65.16 -42.35 96.49 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 124.935 1.255 . . . . 0.0 113.834 171.306 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -63.33 -47.31 82.74 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 120.211 2.006 . . . . 0.0 110.679 177.475 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.4 pp -70.36 -32.49 70.2 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -176.166 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.15 -9.04 31.58 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 119.783 1.174 . . . . 0.0 112.854 175.228 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 80.43 -26.5 3.03 Favored Glycine 0 CA--C 1.541 1.659 0 C-N-CA 125.909 1.718 . . . . 0.0 113.437 -171.317 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -161.27 134.84 6.61 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 128.741 2.817 . . . . 0.0 109.425 176.25 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -142.6 28.56 1.61 Allowed 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 119.132 0.878 . . . . 0.0 111.32 174.01 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.2 m -91.78 142.69 27.31 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 121.591 -0.693 . . . . 0.0 111.95 -178.572 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 50.0 p90 -160.97 169.44 22.56 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.315 1.046 . . . . 0.0 112.41 -169.982 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 5.3 t -125.01 136.49 53.76 Favored 'General case' 0 N--CA 1.462 0.148 0 C-N-CA 123.584 0.754 . . . . 0.0 110.755 169.305 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 33.9 m -71.35 -11.69 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 N-CA-C 114.325 1.231 . . . . 0.0 114.325 -174.038 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -73.88 -11.21 60.29 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.338 1.055 . . . . 0.0 113.549 169.489 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 47.0 t0 -121.39 77.71 35.36 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 126.9 2.08 . . . . 0.0 109.303 179.135 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -71.39 -28.26 18.29 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 123.478 2.786 . . . . 0.0 115.017 -169.347 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 49.8 m -57.35 -52.26 75.56 Favored Pre-proline 0 N--CA 1.477 0.898 0 CA-C-N 119.987 1.267 . . . . 0.0 114.25 -177.782 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -66.47 -30.63 43.54 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 122.193 1.929 . . . . 0.0 113.239 176.097 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 40.8 tp -65.55 -48.29 72.93 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.281 1.032 . . . . 0.0 110.312 175.502 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -60.45 -41.48 94.17 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 118.484 -0.769 . . . . 0.0 112.405 172.365 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -58.28 -47.53 83.34 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 120.128 1.331 . . . . 0.0 112.645 -179.717 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 46.0 mtm -66.32 -49.6 66.46 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.461 0.705 . . . . 0.0 112.314 175.643 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.7 mp -65.58 -37.16 85.87 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-O 117.957 -1.021 . . . . 0.0 111.571 -177.212 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 91.4 mtt180 -55.43 -22.7 21.45 Favored 'General case' 0 N--CA 1.484 1.226 0 CA-C-N 120.732 1.606 . . . . 0.0 113.828 169.678 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -92.16 -16.24 26.54 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.792 1.637 . . . . 0.0 113.709 175.592 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -128.72 -10.83 4.96 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 116.185 1.921 . . . . 0.0 116.185 -176.492 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.1 tt . . . . . 0 CA--C 1.542 0.666 0 C-N-CA 126.84 2.056 . . . . 0.0 111.315 -167.508 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 22.2 m . . . . . 0 N--CA 1.477 0.914 0 CA-C-O 120.725 0.298 . . . . 0.0 110.907 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 43.8 mtt180 -92.24 140.7 24.46 Favored Pre-proline 0 N--CA 1.48 1.027 0 C-N-CA 124.098 0.959 . . . . 0.0 111.502 -176.628 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -76.34 176.72 9.7 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 123.667 2.912 . . . . 0.0 111.327 169.578 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt -68.19 153.39 43.84 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.547 0.739 . . . . 0.0 110.58 179.44 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 93.5 mt -60.65 -43.9 93.68 Favored Pre-proline 0 N--CA 1.478 0.946 0 N-CA-C 114.543 1.312 . . . . 0.0 114.543 -169.376 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -65.85 -26.2 52.3 Favored 'Trans proline' 0 C--N 1.353 0.794 0 CA-C-N 121.616 1.613 . . . . 0.0 113.287 172.184 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.39 -42.33 75.27 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.437 1.095 . . . . 0.0 110.948 174.776 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.7 tt -61.12 -36.7 80.45 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 120.969 -1.082 . . . . 0.0 111.292 170.042 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -63.77 -37.95 89.27 Favored 'General case' 0 N--CA 1.482 1.154 0 O-C-N 121.082 -1.011 . . . . 0.0 113.394 169.839 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.8 mt -60.26 -41.63 87.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 CA-C-N 120.238 1.381 . . . . 0.0 111.434 171.05 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.8 mp -66.61 -36.71 83.26 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 119.428 1.013 . . . . 0.0 112.133 174.175 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 28.5 m170 -63.36 -43.17 98.43 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 121.046 -1.034 . . . . 0.0 111.674 172.007 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.66 -28.31 69.83 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.266 1.027 . . . . 0.0 113.042 173.539 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.492 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -69.44 -15.07 63.21 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 124.155 0.982 . . . . 0.0 113.302 172.471 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 102.23 8.17 44.82 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 125.997 1.76 . . . . 0.0 114.884 -176.242 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -95.95 173.38 7.46 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 118.803 1.301 . . . . 0.0 113.901 -176.594 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.5 tm0? -136.77 143.28 43.15 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.921 1.688 . . . . 0.0 109.248 169.59 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 169.68 -179.73 41.94 Favored Glycine 0 N--CA 1.467 0.706 0 N-CA-C 115.241 0.856 . . . . 0.0 115.241 179.738 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -139.47 -57.23 0.58 Allowed 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.129 1.772 . . . . 0.0 110.824 -178.068 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 16.0 mtm -103.73 142.01 35.1 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 127.988 2.515 . . . . 0.0 111.257 173.165 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -154.79 144.99 21.9 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.292 1.037 . . . . 0.0 112.662 -176.138 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 43.7 p -76.12 172.04 13.48 Favored 'General case' 0 N--CA 1.484 1.263 0 O-C-N 121.121 -0.987 . . . . 0.0 111.094 168.334 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -56.76 -40.95 73.81 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.258 0 O-C-N 120.718 -1.239 . . . . 0.0 110.683 168.754 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -68.24 -40.76 81.91 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.429 1.092 . . . . 0.0 112.61 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 59.7 mt-10 -66.65 -40.99 88.93 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.591 0.756 . . . . 0.0 111.551 175.771 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 52.9 t -61.37 -48.58 88.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 O-C-N 121.785 -0.572 . . . . 0.0 110.841 171.525 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.43 -38.12 89.93 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 125.91 1.684 . . . . 0.0 113.955 -176.402 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 85.3 t60 -53.24 -51.6 61.65 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.297 0.639 . . . . 0.0 111.623 171.077 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -74.56 -32.48 62.43 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 176.785 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -71.85 -39.25 69.84 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.674 1.124 . . . . 0.0 112.564 178.861 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -60.4 -41.11 98.4 Favored Glycine 0 CA--C 1.536 1.393 0 CA-C-N 119.358 0.981 . . . . 0.0 111.732 171.724 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.6 tp60 -60.24 -51.37 69.86 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.479 1.512 . . . . 0.0 111.913 170.555 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.492 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 55.6 t80 -58.93 -49.99 75.73 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.0 -1.062 . . . . 0.0 110.397 179.766 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 56.7 mt -62.29 -36.51 74.94 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 124.896 1.278 . . . . 0.0 111.373 179.298 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 5.8 tpt -64.58 -40.08 94.89 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 119.6 1.091 . . . . 0.0 112.26 172.646 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 96.6 t -78.31 -34.08 18.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 124.293 1.037 . . . . 0.0 112.971 -179.052 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 47.4 mmtt -89.11 -15.68 33.31 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.89 1.276 . . . . 0.0 113.06 178.439 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 14.8 mp0 49.06 69.11 0.61 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.409 2.284 . . . . 0.0 112.601 -171.204 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 9.8 tp -90.74 -1.49 57.85 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.119 0.968 . . . . 0.0 112.776 -176.369 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -102.09 158.64 16.02 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.861 2.064 . . . . 0.0 111.184 175.403 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -88.47 127.69 35.52 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 169.117 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.26 -33.21 52.14 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.882 1.068 . . . . 0.0 113.882 179.553 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -90.38 -16.28 29.42 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.577 1.151 . . . . 0.0 112.466 -173.388 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -143.1 64.56 1.35 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 128.059 2.544 . . . . 0.0 109.432 -177.071 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -60.06 -21.82 61.92 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 121.241 -0.912 . . . . 0.0 113.053 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 5.6 p-80 -65.87 -6.55 12.55 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.31 1.444 . . . . 0.0 114.18 169.572 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 7.2 tpp -117.55 132.12 56.58 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 127.376 2.27 . . . . 0.0 110.379 174.592 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 11.7 t -115.4 123.28 70.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 126.017 1.727 . . . . 0.0 108.298 175.28 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 81.0 t80 -109.14 103.68 12.72 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.21 1.004 . . . . 0.0 109.913 -178.068 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 73.0 m -95.67 15.11 20.89 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -175.047 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.54 118.8 14.8 Favored Glycine 0 CA--C 1.535 1.334 0 O-C-N 121.468 -0.77 . . . . 0.0 112.093 179.584 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 76.96 5.62 84.86 Favored Glycine 0 CA--C 1.541 1.717 0 C-N-CA 124.485 1.04 . . . . 0.0 115.512 -175.544 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -93.79 158.66 15.55 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.189 1.494 . . . . 0.0 112.044 174.51 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 64.6 mt -48.96 -35.38 15.01 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.811 1.244 . . . . 0.0 113.286 177.653 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -58.88 -45.37 90.38 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.595 0.758 . . . . 0.0 111.743 175.037 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -74.7 -33.93 54.59 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 125.407 1.48 . . . . 0.0 113.902 176.963 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -59.32 -46.55 88.3 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-N 120.748 2.274 . . . . 0.0 110.096 171.631 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 32.0 tp -68.88 -51.63 38.16 Favored 'General case' 0 CA--C 1.552 1.054 0 CA-C-N 114.303 -1.317 . . . . 0.0 113.178 -176.782 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -89.55 -8.34 52.95 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 124.312 1.045 . . . . 0.0 112.608 -177.224 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 83.98 -27.04 4.56 Favored Glycine 0 CA--C 1.541 1.657 0 O-C-N 119.866 -1.771 . . . . 0.0 112.714 -169.566 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.12 140.31 4.39 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 128.55 2.74 . . . . 0.0 110.655 178.288 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -142.76 35.98 1.43 Allowed 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.795 0.838 . . . . 0.0 110.931 169.411 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 5.1 m -86.86 125.01 33.7 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 120.712 -1.242 . . . . 0.0 109.663 169.935 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -163.6 169.18 18.99 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.176 1.391 . . . . 0.0 111.859 -169.32 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 13.0 m -115.65 136.14 53.36 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.045 -0.98 . . . . 0.0 111.536 176.173 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -77.76 -14.35 14.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 124.483 1.113 . . . . 0.0 113.519 -169.205 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.2 pttt -75.26 -8.36 56.41 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.478 1.511 . . . . 0.0 114.651 169.851 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -117.99 83.88 20.05 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 126.394 1.878 . . . . 0.0 110.522 -175.31 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -67.08 -31.44 36.75 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 123.725 2.95 . . . . 0.0 114.855 -171.677 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 54.5 m -58.32 -51.97 77.96 Favored Pre-proline 0 N--CA 1.476 0.85 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -176.066 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -67.28 -33.98 28.82 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 121.88 1.72 . . . . 0.0 112.58 174.843 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 8.2 tp -60.38 -46.48 89.82 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.867 1.267 . . . . 0.0 110.878 176.958 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -56.97 -38.27 72.75 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.294 0.952 . . . . 0.0 112.52 177.257 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -64.76 -51.46 62.17 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.584 1.084 . . . . 0.0 112.379 177.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -68.52 -29.52 68.13 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 114.06 1.133 . . . . 0.0 114.06 177.538 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 39.7 tp -75.58 -53.54 8.45 Favored 'General case' 0 C--O 1.224 -0.255 0 C-N-CA 126.506 1.922 . . . . 0.0 110.972 178.777 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 49.9 mtp180 -59.48 -27.39 66.08 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-N 119.42 1.009 . . . . 0.0 113.474 -176.664 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -75.97 -26.4 56.76 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.297 1.439 . . . . 0.0 113.691 173.811 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 34.5 m-20 -104.75 -21.54 13.35 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 179.59 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 21.0 tp . . . . . 0 CA--C 1.535 0.373 0 C-N-CA 127.916 2.487 . . . . 0.0 107.337 171.428 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.1 m . . . . . 0 N--CA 1.485 1.288 0 N-CA-C 113.332 0.864 . . . . 0.0 113.332 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.403 ' HG2' ' HB3' ' A' ' 46' ' ' MET . 43.4 mtm180 -69.54 146.89 96.5 Favored Pre-proline 0 N--CA 1.486 1.371 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -169.567 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo -88.9 -177.14 1.56 Allowed 'Trans proline' 0 C--N 1.354 0.823 1 C-N-CA 125.392 4.061 . . . . 0.0 113.447 -176.304 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.0 ttmt -68.03 147.85 51.81 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.745 0.818 . . . . 0.0 109.128 169.182 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 92.4 mt -60.2 -42.07 87.67 Favored Pre-proline 0 N--CA 1.478 0.929 0 N-CA-C 115.354 1.612 . . . . 0.0 115.354 -168.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -59.58 -31.4 94.41 Favored 'Trans proline' 0 CA--C 1.537 0.631 0 CA-C-N 121.76 1.664 . . . . 0.0 114.032 176.35 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.1 tt -64.4 -44.77 90.22 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.071 0.851 . . . . 0.0 110.536 175.914 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 49.7 tp -61.11 -39.04 88.5 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.229 0.612 . . . . 0.0 111.797 175.138 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -67.21 -36.62 82.1 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 175.256 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 87.5 mt -63.89 -42.55 96.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 123.828 0.851 . . . . 0.0 111.346 171.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 97.7 mt -63.65 -37.2 86.45 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.154 -0.966 . . . . 0.0 112.661 173.143 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 65.2 m170 -61.76 -44.66 96.46 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 118.813 0.733 . . . . 0.0 111.581 169.804 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.76 -28.72 69.77 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.184 0.994 . . . . 0.0 112.976 177.955 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.438 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -73.99 -3.81 31.49 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.456 1.102 . . . . 0.0 113.552 172.445 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.81 12.32 60.74 Favored Glycine 0 CA--C 1.536 1.375 0 C-N-CA 125.177 1.37 . . . . 0.0 115.355 177.17 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -106.93 156.39 18.76 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.011 1.325 . . . . 0.0 112.736 -179.714 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -80.62 -178.48 6.76 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.684 -0.635 . . . . 0.0 111.07 169.071 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 176.79 155.01 12.56 Favored Glycine 0 C--N 1.34 0.781 0 N-CA-C 118.497 2.159 . . . . 0.0 118.497 176.772 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -147.01 -67.71 0.26 Allowed 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 127.227 2.211 . . . . 0.0 108.078 169.18 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.403 ' HB3' ' HG2' ' A' ' 28' ' ' ARG . 1.5 pmm? -130.09 154.63 47.27 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 126.214 1.806 . . . . 0.0 115.548 176.388 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -154.57 160.81 41.72 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 115.183 1.549 . . . . 0.0 115.183 -168.945 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 44.6 p -96.42 173.26 7.46 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 127.028 2.131 . . . . 0.0 109.893 167.712 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.2 t -56.54 -41.94 74.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 CA-C-N 120.785 1.629 . . . . 0.0 110.001 169.884 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 56.8 tptt -60.27 -43.17 96.43 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.729 1.15 . . . . 0.0 112.386 -179.671 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -74.12 -36.89 64.23 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 83.3 t -67.85 -50.57 58.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 CA-C-N 118.959 0.799 . . . . 0.0 111.013 172.48 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.6 ppp? -69.54 -26.52 64.54 Favored 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 114.55 1.315 . . . . 0.0 114.55 -168.572 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -57.77 -54.24 49.08 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.289 0.636 . . . . 0.0 110.826 171.121 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -74.54 -31.08 62.01 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 176.379 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -69.43 -39.1 78.06 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 120.61 1.55 . . . . 0.0 112.627 175.886 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.6 -47.36 89.81 Favored Glycine 0 CA--C 1.53 1.011 0 CA-C-N 118.986 0.812 . . . . 0.0 111.466 172.051 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.0 tp60 -57.62 -43.22 84.61 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.313 1.045 . . . . 0.0 112.356 172.503 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.438 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 59.4 t80 -62.79 -53.8 48.8 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.28 1.432 . . . . 0.0 110.621 177.962 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 34.7 mt -57.04 -37.36 54.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 124.288 1.035 . . . . 0.0 110.751 177.152 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 40.3 mmm -70.23 -41.47 73.55 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 114.141 1.163 . . . . 0.0 114.141 176.191 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.8 p -78.48 -26.31 13.92 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 CA-C-N 119.974 1.261 . . . . 0.0 112.99 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 55.5 mmtt -91.77 -14.44 29.87 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.817 1.647 . . . . 0.0 113.253 173.792 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.8 mp0 52.19 62.3 2.77 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 126.766 2.026 . . . . 0.0 113.673 -176.182 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 45.8 mt -88.37 -5.24 58.42 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 121.576 -0.703 . . . . 0.0 112.749 174.693 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 46.3 p90 -84.62 157.19 21.25 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.986 1.314 . . . . 0.0 111.703 172.573 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -87.41 126.83 35.11 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 169.454 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.46 -30.74 61.11 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 179.084 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -94.73 -21.08 18.98 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.712 1.205 . . . . 0.0 112.809 -170.74 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -140.07 68.44 1.36 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 127.765 2.426 . . . . 0.0 109.056 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -63.35 -16.96 61.99 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 114.05 1.13 . . . . 0.0 114.05 -169.845 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 32.8 p80 -61.53 -29.89 70.29 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 118.706 -0.664 . . . . 0.0 112.689 169.921 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 17.9 mtp -87.99 145.5 25.97 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 113.62 0.971 . . . . 0.0 113.62 176.186 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 t -131.0 131.21 64.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 C-N-CA 126.073 1.749 . . . . 0.0 108.743 173.825 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -112.66 103.57 11.61 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.553 1.541 . . . . 0.0 108.758 174.571 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 15.0 m -103.05 9.69 38.42 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.73 0.812 . . . . 0.0 112.402 176.008 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.75 -27.32 66.35 Favored Glycine 0 CA--C 1.537 1.444 0 C-N-CA 124.999 1.285 . . . . 0.0 114.795 -174.336 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -88.24 2.09 84.94 Favored Glycine 0 CA--C 1.54 1.631 0 C-N-CA 124.988 1.28 . . . . 0.0 115.202 173.789 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -110.67 177.78 4.57 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.471 1.508 . . . . 0.0 112.727 -175.061 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 80.4 mt -51.73 -35.84 44.79 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.205 1.402 . . . . 0.0 113.201 171.913 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 94.5 mt -61.2 -47.91 83.97 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 121.624 -0.673 . . . . 0.0 110.933 174.643 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -67.8 -34.79 83.76 Favored Glycine 0 CA--C 1.532 1.142 0 CA-C-O 119.032 -0.871 . . . . 0.0 113.464 176.709 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.42 -28.77 63.18 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 119.43 1.615 . . . . 0.0 112.449 176.904 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 40.8 tp -74.42 -53.61 9.23 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.875 1.27 . . . . 0.0 112.416 173.366 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -96.82 -17.24 20.34 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.787 1.403 . . . . 0.0 114.787 -169.442 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 80.85 -17.96 10.21 Favored Glycine 0 CA--C 1.539 1.584 0 C-N-CA 125.66 1.6 . . . . 0.0 116.061 -177.85 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.04 31.13 0.62 Allowed 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 116.362 1.986 . . . . 0.0 116.362 -174.23 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 8.0 mm-40 -69.35 73.17 0.33 Allowed 'General case' 0 N--CA 1.477 0.886 0 O-C-N 121.336 -0.852 . . . . 0.0 112.853 -179.208 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 12.1 m -134.38 136.43 43.36 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.083 1.353 . . . . 0.0 109.178 169.147 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 54.5 p90 -160.08 174.06 14.88 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -168.545 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.8 t -124.59 141.42 52.11 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 124.852 1.261 . . . . 0.0 110.548 169.019 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 25.9 m -72.0 -12.28 15.73 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 175.21 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 41.4 pttt -77.35 -10.71 59.61 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 113.683 0.994 . . . . 0.0 113.683 172.851 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -123.48 77.42 54.54 Favored Pre-proline 0 CA--C 1.548 0.866 0 C-N-CA 126.285 1.834 . . . . 0.0 109.642 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -68.83 -28.05 30.44 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 123.389 2.726 . . . . 0.0 114.873 -169.355 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 62.5 m -59.4 -55.14 49.05 Favored Pre-proline 0 N--CA 1.476 0.863 0 CA-C-N 120.172 1.351 . . . . 0.0 114.436 -177.444 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -65.88 -29.74 49.65 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 122.11 1.873 . . . . 0.0 112.93 176.438 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 26.5 tp -66.37 -46.48 76.55 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.89 0.876 . . . . 0.0 110.746 174.836 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -61.83 -39.25 91.14 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 118.557 -0.735 . . . . 0.0 112.638 172.253 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -59.36 -48.9 79.88 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 119.778 1.172 . . . . 0.0 112.599 177.442 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 41.3 mtm -62.31 -47.91 82.2 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.653 0.781 . . . . 0.0 112.634 173.947 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 61.7 mt -56.65 -45.26 81.73 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 124.312 1.045 . . . . 0.0 110.978 177.373 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 24.0 ttt180 -60.42 -21.64 62.47 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 120.052 1.296 . . . . 0.0 114.234 175.147 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -86.85 -17.5 33.21 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.5 1.52 . . . . 0.0 113.208 172.727 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 53.9 t30 -104.92 -25.19 12.69 Favored 'General case' 0 CA--C 1.555 1.138 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 176.547 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 55.1 tp . . . . . 0 CA--C 1.535 0.373 0 C-N-CA 128.739 2.816 . . . . 0.0 108.548 179.863 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 23.4 m . . . . . 0 N--CA 1.478 0.943 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.7 ttp-105 -101.39 129.85 26.04 Favored Pre-proline 0 N--CA 1.481 1.099 0 O-C-N 120.876 -1.14 . . . . 0.0 111.408 178.281 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -75.24 -177.03 3.22 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.736 2.958 . . . . 0.0 112.121 173.932 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.5 ttmt -64.06 148.09 50.6 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 121.394 -0.816 . . . . 0.0 110.668 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.9 mt -55.84 -45.85 99.83 Favored Pre-proline 0 N--CA 1.476 0.836 0 N-CA-C 115.225 1.565 . . . . 0.0 115.225 -168.361 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -64.8 -24.17 61.8 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 CA-C-N 122.219 1.828 . . . . 0.0 113.773 175.096 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 tp -66.68 -40.26 88.49 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.774 1.17 . . . . 0.0 110.919 172.194 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.9 tt -63.37 -37.91 89.09 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.824 0.85 . . . . 0.0 111.41 171.3 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.433 ' HA ' ' HE2' ' A' ' 35' ' ' LYS . 11.1 mmpt? -60.99 -43.21 99.2 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 121.516 -0.74 . . . . 0.0 112.565 171.242 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 83.3 mt -62.75 -42.38 96.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.994 0.918 . . . . 0.0 111.5 174.542 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 55.8 mt -63.57 -38.61 91.79 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.473 -0.767 . . . . 0.0 111.671 176.735 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 17.6 m170 -67.67 -41.05 84.32 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.584 -0.697 . . . . 0.0 111.789 172.955 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.37 -26.83 68.93 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.182 0.993 . . . . 0.0 113.292 174.043 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.435 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -71.25 -6.78 42.31 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.154 0.982 . . . . 0.0 113.462 171.833 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 94.75 7.19 60.24 Favored Glycine 0 CA--C 1.536 1.397 0 C-N-CA 125.638 1.59 . . . . 0.0 115.063 -178.535 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -89.09 170.64 10.46 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 118.931 1.365 . . . . 0.0 112.874 178.189 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 34.4 tp60 -128.14 139.03 52.72 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.607 1.563 . . . . 0.0 109.013 169.378 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 175.94 150.8 8.28 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 115.275 0.87 . . . . 0.0 115.275 -179.534 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -125.06 13.39 8.4 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 127.023 2.129 . . . . 0.0 111.641 172.398 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.2 mtm -174.9 134.44 0.35 Allowed 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 128.916 2.886 . . . . 0.0 109.343 -172.146 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -154.08 143.88 21.78 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.192 0.997 . . . . 0.0 113.145 -174.588 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 51.4 p -85.75 170.06 12.82 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 121.058 -1.026 . . . . 0.0 111.203 168.657 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 2.7 t -55.81 -43.92 75.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 O-C-N 120.337 -1.477 . . . . 0.0 110.391 169.378 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -57.29 -34.69 68.94 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 120.813 -1.179 . . . . 0.0 113.002 177.983 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -80.43 -45.79 17.04 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 113.183 0.808 . . . . 0.0 113.183 173.618 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 79.5 t -61.61 -49.1 85.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 123.482 0.713 . . . . 0.0 110.895 -177.711 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.71 -38.58 83.81 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 123.375 0.67 . . . . 0.0 111.944 -172.895 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -56.46 -52.45 64.65 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.423 176.558 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 45.9 m-85 -74.41 -29.93 61.71 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 176.782 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.4 mp -68.28 -37.91 81.18 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 120.793 1.633 . . . . 0.0 112.215 171.687 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -61.95 -43.41 99.22 Favored Glycine 0 CA--C 1.531 1.069 0 CA-C-N 119.13 0.877 . . . . 0.0 111.828 171.549 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.2 tp60 -60.89 -43.09 98.96 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.394 1.077 . . . . 0.0 112.446 171.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.435 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 49.4 t80 -61.35 -51.78 67.37 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.205 1.002 . . . . 0.0 110.58 175.44 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 69.1 mt -59.8 -38.56 76.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 124.54 1.136 . . . . 0.0 110.825 179.095 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.2 tpt -63.63 -47.63 80.56 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.985 1.314 . . . . 0.0 112.509 174.127 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.2 p -78.63 -28.46 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 -175.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 57.5 mmtt -91.97 -15.78 27.48 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.459 1.503 . . . . 0.0 113.522 174.987 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.4 mp0 55.06 63.6 2.07 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.947 2.099 . . . . 0.0 112.992 -174.07 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 11.2 tp -88.29 -9.37 53.06 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.003 0.921 . . . . 0.0 112.3 176.739 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 26.4 p90 -88.58 162.08 16.57 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.134 1.774 . . . . 0.0 110.874 169.857 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -99.9 129.67 46.01 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 122.029 -0.42 . . . . 0.0 110.72 169.629 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.2 -20.57 59.29 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 113.934 1.087 . . . . 0.0 113.934 173.847 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -82.94 -31.44 27.7 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.639 1.176 . . . . 0.0 111.347 -178.648 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -152.33 69.99 0.9 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.262 1.825 . . . . 0.0 111.957 -169.885 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 27.9 mp0 -56.36 -20.8 20.91 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.233 1.413 . . . . 0.0 113.795 -178.709 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 30.5 p80 -65.32 -12.82 55.67 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 174.067 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 22.5 tpp -111.61 135.97 51.46 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 126.621 1.968 . . . . 0.0 111.105 172.211 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 18.9 t -119.7 107.89 22.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 125.713 1.605 . . . . 0.0 108.309 171.689 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -92.15 110.98 22.37 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.223 0.609 . . . . 0.0 110.672 -177.143 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 84.3 m -103.58 14.84 30.35 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 -170.984 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.47 120.74 23.6 Favored Glycine 0 CA--C 1.535 1.303 0 O-C-N 121.411 -0.805 . . . . 0.0 111.711 176.235 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 80.0 0.59 85.93 Favored Glycine 0 CA--C 1.54 1.625 0 C-N-CA 124.533 1.063 . . . . 0.0 115.575 -174.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -80.39 158.07 26.11 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.42 1.61 . . . . 0.0 111.496 171.191 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 10.9 mp -46.69 -41.16 14.51 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.312 1.445 . . . . 0.0 112.336 169.946 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 98.6 mt -57.52 -43.39 84.26 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.028 0.931 . . . . 0.0 111.703 174.799 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -72.64 -36.74 58.26 Favored Glycine 0 CA--C 1.53 0.981 0 CA-C-O 118.499 -1.167 . . . . 0.0 113.42 178.812 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -62.56 -42.55 99.61 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 120.318 2.059 . . . . 0.0 110.425 173.05 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 30.9 tp -65.34 -50.44 65.62 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.314 1.046 . . . . 0.0 113.191 -179.139 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -95.06 -7.64 38.98 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 124.782 1.233 . . . . 0.0 112.611 -175.363 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 82.47 -28.05 3.54 Favored Glycine 0 CA--C 1.541 1.662 0 C-N-CA 125.795 1.664 . . . . 0.0 113.167 -169.894 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.48 136.51 6.4 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 129.01 2.924 . . . . 0.0 109.265 176.544 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -139.32 22.96 2.55 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 119.267 0.939 . . . . 0.0 112.218 177.512 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 14.7 m -84.78 129.59 34.8 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 179.46 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 5.1 p90 -159.29 171.26 20.15 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.854 -1.066 . . . . 0.0 112.251 -168.695 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 79.9 p -113.39 136.26 52.96 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 114.659 -1.155 . . . . 0.0 113.434 177.122 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 3.7 m -77.65 -9.86 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 N-CA-C 114.066 1.136 . . . . 0.0 114.066 -177.243 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -80.91 -8.73 59.81 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.859 1.664 . . . . 0.0 115.149 174.227 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 39.0 t0 -131.29 90.11 39.24 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 125.519 1.527 . . . . 0.0 111.197 -172.898 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -67.46 -27.39 39.76 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 123.595 2.863 . . . . 0.0 115.08 -174.487 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 66.0 m -61.11 -53.16 66.21 Favored Pre-proline 0 N--CA 1.476 0.872 0 N-CA-C 114.326 1.232 . . . . 0.0 114.326 -177.562 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -66.6 -31.64 40.5 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 122.364 2.043 . . . . 0.0 112.761 175.997 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 6.5 tp -60.98 -49.02 79.12 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.779 1.232 . . . . 0.0 111.093 173.643 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -59.03 -29.26 67.15 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 -176.413 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -68.78 -51.52 40.14 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.604 1.093 . . . . 0.0 111.822 177.877 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 3.4 ptt? -68.86 -29.52 67.84 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.021 0.928 . . . . 0.0 112.633 178.116 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 17.7 tp -76.15 -47.13 25.44 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 126.821 2.049 . . . . 0.0 111.44 179.409 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 74.5 mtt180 -57.34 -27.47 62.27 Favored 'General case' 0 N--CA 1.485 1.282 0 CA-C-N 120.379 1.445 . . . . 0.0 113.16 176.08 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 90.4 mttt -76.49 -24.02 53.79 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.511 1.525 . . . . 0.0 113.509 174.738 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 60.2 m-20 -112.64 -22.23 10.86 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -177.904 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.6 tt . . . . . 0 CA--C 1.543 0.678 0 C-N-CA 127.701 2.4 . . . . 0.0 108.265 -173.856 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 24.1 m . . . . . 0 N--CA 1.479 0.984 0 CA-C-O 120.238 0.066 . . . . 0.0 110.869 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 -79.7 144.55 60.72 Favored Pre-proline 0 N--CA 1.483 1.201 0 O-C-N 121.125 -0.984 . . . . 0.0 110.934 -172.525 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -73.12 176.71 8.75 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 123.542 2.828 . . . . 0.0 112.291 176.588 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -58.22 146.81 32.52 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.873 0.869 . . . . 0.0 110.054 173.892 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.1 mp -56.5 -46.41 99.82 Favored Pre-proline 0 N--CA 1.476 0.864 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -169.312 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -66.75 -25.27 46.4 Favored 'Trans proline' 0 C--N 1.351 0.687 0 CA-C-N 121.513 1.576 . . . . 0.0 113.706 176.007 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.1 tt -69.73 -40.84 75.97 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.235 0.925 . . . . 0.0 109.972 173.334 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 28.6 tp -59.6 -36.92 77.24 Favored 'General case' 0 CA--C 1.547 0.846 0 O-C-N 120.954 -1.091 . . . . 0.0 111.421 169.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 19.7 mmtp -67.1 -33.72 76.08 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 173.903 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 83.4 mt -62.29 -38.99 82.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 124.439 1.096 . . . . 0.0 111.728 170.687 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.7 mp -68.95 -37.22 78.73 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 120.076 1.307 . . . . 0.0 112.356 171.257 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 58.7 m170 -60.87 -43.55 98.26 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 119.22 0.918 . . . . 0.0 111.697 172.176 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.66 -23.44 67.26 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.939 1.296 . . . . 0.0 113.416 175.881 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.468 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -72.08 -6.7 44.33 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 123.711 0.804 . . . . 0.0 113.089 171.624 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.73 19.38 40.82 Favored Glycine 0 CA--C 1.536 1.351 0 C-N-CA 125.142 1.353 . . . . 0.0 114.712 178.819 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -126.24 145.27 50.47 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.868 1.267 . . . . 0.0 113.133 -175.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -74.5 153.6 39.05 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.915 0.886 . . . . 0.0 110.177 169.762 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -150.76 134.92 4.94 Favored Glycine 0 CA--C 1.529 0.922 0 N-CA-C 115.601 1.0 . . . . 0.0 115.601 179.479 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -148.88 78.57 1.4 Allowed 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 127.168 2.187 . . . . 0.0 108.847 173.592 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . 0.435 0.0 OUTLIER 64.87 141.01 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 129.536 3.134 . . . . 0.0 117.838 176.072 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -161.8 171.56 17.6 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 114.055 1.131 . . . . 0.0 114.055 -168.735 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 37.7 p -96.47 174.23 6.96 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 127.109 2.163 . . . . 0.0 112.523 169.804 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 15.9 t -50.19 -46.12 24.6 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 O-C-N 121.173 -0.954 . . . . 0.0 111.545 171.389 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -57.37 -38.51 74.33 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.752 0.821 . . . . 0.0 112.639 -176.667 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -80.51 -34.95 35.26 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.42 1.088 . . . . 0.0 112.948 176.612 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 73.2 t -72.79 -45.88 55.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 O-C-N 121.215 -0.928 . . . . 0.0 112.291 -179.759 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 22.3 mmt -64.59 -30.66 71.68 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-N 120.012 1.278 . . . . 0.0 112.643 -178.303 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 85.4 t60 -53.85 -53.75 48.18 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.431 173.7 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -74.61 -34.27 62.79 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 174.777 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -70.29 -43.72 69.82 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.775 1.17 . . . . 0.0 112.814 -179.411 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.98 -39.68 98.37 Favored Glycine 0 CA--C 1.531 1.084 0 CA-C-N 118.843 0.747 . . . . 0.0 111.873 173.839 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.2 tp60 -61.18 -48.09 83.16 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.667 1.187 . . . . 0.0 111.934 172.146 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.468 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 66.3 t80 -60.7 -50.07 74.95 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.811 0.844 . . . . 0.0 110.885 177.29 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 60.4 mt -61.76 -35.76 69.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 124.817 1.247 . . . . 0.0 111.26 179.006 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.2 tpt -65.53 -39.52 91.87 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.595 1.158 . . . . 0.0 112.514 171.546 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 84.3 t -78.32 -32.97 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 CA-C-N 119.336 0.971 . . . . 0.0 112.969 -179.065 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 47.8 mmtt -90.46 -15.53 30.68 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.021 1.329 . . . . 0.0 113.15 177.925 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.3 mp0 50.17 66.45 1.14 Allowed 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 127.295 2.238 . . . . 0.0 113.183 -173.314 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 51.5 mt -91.2 0.64 57.49 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.52 0.728 . . . . 0.0 112.901 177.541 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 54.4 p90 -89.3 157.49 18.18 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.945 1.298 . . . . 0.0 111.354 171.268 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -88.52 134.58 33.82 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 121.86 -0.525 . . . . 0.0 110.69 169.69 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.47 -21.34 65.39 Favored 'General case' 0 CA--C 1.544 0.727 0 O-C-N 120.893 -1.129 . . . . 0.0 113.689 172.942 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -82.69 -34.57 27.32 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.704 1.202 . . . . 0.0 111.101 -179.41 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -147.89 76.35 1.38 Allowed 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 128.035 2.534 . . . . 0.0 109.43 -169.66 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 26.3 mp0 -59.34 -23.56 62.61 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.299 -0.876 . . . . 0.0 113.003 -178.232 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 3.3 p-80 -66.12 -23.22 66.45 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 171.924 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 12.6 tpp -87.06 132.05 33.93 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.758 1.223 . . . . 0.0 110.092 170.587 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.7 t -124.41 112.09 30.99 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 C-N-CA 126.577 1.951 . . . . 0.0 108.968 -175.936 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 58.0 t80 -89.98 59.26 4.47 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.411 1.485 . . . . 0.0 111.468 -176.333 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 52.5 m -72.28 -4.51 30.06 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 120.832 -1.168 . . . . 0.0 113.021 171.651 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.3 -24.65 59.27 Favored Glycine 0 CA--C 1.541 1.682 0 CA-C-N 120.648 1.567 . . . . 0.0 113.819 169.725 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -91.1 6.54 81.5 Favored Glycine 0 CA--C 1.542 1.778 0 C-N-CA 125.528 1.537 . . . . 0.0 115.326 171.688 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -112.13 171.1 7.71 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.249 1.82 . . . . 0.0 112.494 -173.729 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.1 mp -47.16 -40.23 15.37 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.244 1.418 . . . . 0.0 111.969 169.257 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.1 tp -64.76 -32.22 73.81 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.879 0.872 . . . . 0.0 111.945 175.988 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -75.11 -35.09 50.38 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 126.515 2.007 . . . . 0.0 114.458 174.331 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -65.63 -42.62 91.29 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 119.791 1.796 . . . . 0.0 110.232 169.978 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 25.6 tp -60.59 -49.33 77.96 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.155 1.382 . . . . 0.0 112.588 179.29 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.34 -11.09 21.52 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 115.478 1.658 . . . . 0.0 115.478 -177.937 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.11 -18.81 8.95 Favored Glycine 0 CA--C 1.539 1.59 0 C-N-CA 125.843 1.687 . . . . 0.0 115.968 179.626 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.33 28.64 0.57 Allowed 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 115.018 1.488 . . . . 0.0 115.018 -175.617 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -70.66 46.34 0.09 Allowed 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 116.212 1.93 . . . . 0.0 116.212 -168.21 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 41.0 m -105.93 142.41 35.68 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 120.789 -1.194 . . . . 0.0 110.491 170.155 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -161.39 171.4 18.31 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 -168.126 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 3.5 m -121.92 136.26 54.92 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.247 1.019 . . . . 0.0 111.389 174.689 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 22.4 m -74.22 -21.65 17.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 C-N-CA 124.214 1.005 . . . . 0.0 113.707 -175.239 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -72.72 -8.58 56.06 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 125.335 1.454 . . . . 0.0 114.375 174.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 47.0 t0 -117.64 82.78 16.47 Favored Pre-proline 0 CA--C 1.547 0.851 0 C-N-CA 126.786 2.034 . . . . 0.0 109.097 -179.521 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -66.57 -31.9 40.25 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 123.478 2.785 . . . . 0.0 114.591 -169.818 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 55.7 m -56.7 -54.19 56.53 Favored Pre-proline 0 N--CA 1.476 0.856 0 CA-C-N 120.057 1.299 . . . . 0.0 113.949 -176.816 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -66.2 -28.52 47.98 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 122.071 1.847 . . . . 0.0 113.209 175.909 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 32.4 tp -69.61 -43.47 72.68 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.145 -0.972 . . . . 0.0 111.255 176.842 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -65.92 -34.3 77.8 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 121.496 -0.753 . . . . 0.0 112.329 171.42 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -63.08 -46.74 86.01 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.348 0.976 . . . . 0.0 112.578 175.006 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.488 ' HE3' ' HB2' ' A' ' 101' ' ' MET . 47.7 mtm -60.2 -49.92 75.73 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.244 0.618 . . . . 0.0 111.656 170.87 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 49.6 mt -59.92 -45.52 92.31 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-O 118.023 -0.989 . . . . 0.0 111.648 -176.876 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -55.09 -25.81 33.8 Favored 'General case' 0 N--CA 1.48 1.038 0 CA-C-N 119.926 1.239 . . . . 0.0 114.139 175.745 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -94.22 -16.77 23.34 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 125.322 1.449 . . . . 0.0 114.782 174.318 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 24.9 m-80 -117.95 -41.86 2.87 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-N 119.418 1.008 . . . . 0.0 113.598 -171.762 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 39.5 tp . . . . . 0 CA--C 1.54 0.565 0 C-N-CA 126.614 1.966 . . . . 0.0 107.971 169.561 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.1 m . . . . . 0 N--CA 1.477 0.908 0 CA-C-O 120.627 0.251 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 42.8 ttp180 -110.42 134.98 20.68 Favored Pre-proline 0 N--CA 1.479 0.987 0 C-N-CA 124.195 0.998 . . . . 0.0 112.914 -169.757 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.01 159.2 54.08 Favored 'Trans proline' 0 CA--C 1.537 0.637 0 C-N-CA 122.367 2.044 . . . . 0.0 111.788 169.575 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -55.55 161.19 2.12 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 115.027 1.492 . . . . 0.0 115.027 177.623 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 22.2 mt -61.15 -41.72 82.26 Favored Pre-proline 0 CA--C 1.548 0.881 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 -168.672 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -70.08 -30.76 20.28 Favored 'Trans proline' 0 C--N 1.355 0.871 0 C-N-CA 122.152 1.901 . . . . 0.0 112.763 169.557 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 tt -71.95 -43.87 64.5 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.795 1.238 . . . . 0.0 110.841 -175.244 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 23.8 tp -53.65 -37.28 62.97 Favored 'General case' 0 CA--C 1.548 0.899 0 O-C-N 120.98 -1.075 . . . . 0.0 111.801 171.746 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -72.41 -19.18 61.64 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.198 0.999 . . . . 0.0 113.695 177.508 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 84.7 mt -69.49 -41.72 80.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 CA-C-N 118.988 0.813 . . . . 0.0 109.074 168.092 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.4 mp -66.73 -35.92 81.25 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 121.564 -0.71 . . . . 0.0 110.913 175.192 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 50.6 m170 -60.85 -49.51 77.17 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 118.362 0.528 . . . . 0.0 111.535 169.524 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.18 -23.85 67.62 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.525 1.13 . . . . 0.0 113.903 177.535 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.402 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -67.43 -14.83 63.28 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.402 1.081 . . . . 0.0 113.066 173.107 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.74 22.52 10.98 Favored Glycine 0 CA--C 1.537 1.415 0 C-N-CA 125.26 1.41 . . . . 0.0 114.557 179.668 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -132.42 154.9 49.38 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.83 1.252 . . . . 0.0 113.581 -174.644 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.9 tt0 -77.39 152.35 34.42 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.718 0.807 . . . . 0.0 110.128 169.534 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -144.73 126.17 2.58 Favored Glycine 0 N--CA 1.469 0.88 0 N-CA-C 114.88 0.712 . . . . 0.0 114.88 178.545 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -151.06 78.35 1.29 Allowed 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 126.748 2.019 . . . . 0.0 108.931 173.772 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 30.7 mtm 67.18 140.86 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 129.668 3.187 . . . . 0.0 117.112 174.189 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -170.41 166.03 8.58 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.983 1.313 . . . . 0.0 113.489 -169.506 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 66.9 p -74.04 167.69 21.01 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 125.188 1.395 . . . . 0.0 111.497 168.697 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -59.63 -39.07 78.55 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.387 0 O-C-N 120.5 -1.375 . . . . 0.0 111.904 174.029 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -62.28 -44.04 97.44 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.716 1.606 . . . . 0.0 112.876 176.146 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -67.84 -37.46 81.91 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 121.908 -0.495 . . . . 0.0 111.857 172.936 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 33.3 t -61.5 -43.91 97.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 123.617 0.767 . . . . 0.0 111.317 173.731 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 19.4 ptp -73.08 -23.93 60.6 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 115.579 1.696 . . . . 0.0 115.579 -178.726 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 84.5 t60 -51.72 -44.04 63.07 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 118.73 0.695 . . . . 0.0 110.321 168.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 -74.79 -44.0 51.79 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 170.302 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.6 mp -67.25 -34.42 77.39 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 120.32 1.418 . . . . 0.0 113.873 -177.296 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.45 -47.37 87.98 Favored Glycine 0 CA--C 1.531 1.091 0 CA-C-N 119.222 0.919 . . . . 0.0 111.572 171.514 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 11.2 tp60 -54.93 -46.14 74.89 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.596 1.158 . . . . 0.0 111.604 171.491 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.402 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 68.8 t80 -62.55 -51.37 67.65 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.656 0.782 . . . . 0.0 110.828 179.826 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 67.8 mt -61.67 -37.24 77.51 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 123.758 0.823 . . . . 0.0 111.034 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 35.4 mmt -67.38 -42.45 83.36 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 174.043 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 6.6 p -78.54 -28.75 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 CA-C-N 119.869 1.213 . . . . 0.0 113.386 -177.246 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 57.4 mmtt -92.2 -15.83 27.04 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.905 1.282 . . . . 0.0 113.446 174.46 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 14.1 mp0 53.12 67.19 1.04 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.213 1.805 . . . . 0.0 113.06 -174.243 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.7 tp -90.31 3.83 52.51 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.34 1.056 . . . . 0.0 112.376 179.641 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 40.0 p90 -109.16 160.59 15.96 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 128.183 2.593 . . . . 0.0 110.725 178.194 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -94.54 130.71 40.84 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 109.273 -0.639 . . . . 0.0 109.273 168.927 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -57.03 -33.81 67.58 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 119.11 0.868 . . . . 0.0 112.737 -175.908 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -87.07 -15.13 39.48 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.873 0.869 . . . . 0.0 112.343 -172.749 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -141.97 57.47 1.48 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 127.875 2.47 . . . . 0.0 110.512 -176.303 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -60.31 -17.46 42.94 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 121.381 -0.824 . . . . 0.0 112.728 178.661 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 6.1 p-80 -63.42 -5.38 3.57 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.272 1.429 . . . . 0.0 114.332 169.619 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 48.1 mtp -128.35 150.75 49.96 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.97 1.259 . . . . 0.0 112.844 169.047 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 t -127.29 140.55 48.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 126.314 1.846 . . . . 0.0 108.243 175.758 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 86.1 m-85 -120.68 68.23 0.86 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.1 0.96 . . . . 0.0 112.622 -168.746 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 1.9 m -84.81 13.5 5.78 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 -170.269 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.82 -28.63 63.47 Favored Glycine 0 CA--C 1.541 1.705 0 O-C-N 120.473 -1.392 . . . . 0.0 114.663 178.689 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -94.15 5.95 72.04 Favored Glycine 0 CA--C 1.541 1.697 0 C-N-CA 125.358 1.456 . . . . 0.0 115.059 172.87 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -97.81 175.59 6.11 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.914 1.686 . . . . 0.0 112.53 -175.055 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 10.5 mp -59.56 -36.32 75.97 Favored 'General case' 0 CA--C 1.547 0.828 0 O-C-N 121.022 -1.048 . . . . 0.0 111.451 169.402 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 80.5 mt -57.64 -41.54 81.61 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.173 -0.954 . . . . 0.0 111.384 169.953 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -69.63 -35.3 74.11 Favored Glycine 0 CA--C 1.533 1.169 0 CA-C-O 118.709 -1.05 . . . . 0.0 113.821 176.084 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -72.94 -29.45 63.11 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 120.333 2.067 . . . . 0.0 111.477 176.398 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 29.2 tp -70.79 -50.47 35.4 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.104 1.362 . . . . 0.0 112.449 174.011 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.58 -6.4 23.9 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 124.628 1.171 . . . . 0.0 113.969 -171.182 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.47 -28.88 2.31 Favored Glycine 0 CA--C 1.54 1.647 0 C-N-CA 125.571 1.558 . . . . 0.0 113.759 -171.676 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.89 135.05 11.18 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 128.134 2.574 . . . . 0.0 110.005 176.85 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -148.54 42.75 0.99 Allowed 'General case' 0 N--CA 1.476 0.857 0 CA-C-O 122.283 1.039 . . . . 0.0 110.373 179.239 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 14.8 m -93.54 136.34 33.91 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 121.5 -0.75 . . . . 0.0 110.268 170.122 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 53.8 p90 -158.85 167.52 29.22 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.293 1.037 . . . . 0.0 113.497 -169.65 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 9.7 t -103.7 136.51 43.27 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.57 1.148 . . . . 0.0 111.468 170.29 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 5.5 m -77.83 -11.7 13.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 N-CA-C 114.859 1.429 . . . . 0.0 114.859 178.235 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 18.8 pttm -84.06 -8.53 59.09 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 115.26 1.578 . . . . 0.0 115.26 -176.981 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 42.2 t0 -120.58 96.22 48.93 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 126.148 1.779 . . . . 0.0 111.132 -169.654 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -60.37 -30.89 91.93 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 124.095 3.197 . . . . 0.0 115.315 -178.428 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 69.3 m -60.44 -55.02 49.24 Favored Pre-proline 0 N--CA 1.477 0.905 0 CA-C-N 120.264 1.393 . . . . 0.0 113.913 -177.368 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -67.1 -27.76 41.66 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 122.064 1.842 . . . . 0.0 112.795 175.182 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 46.4 mt -61.45 -53.95 49.84 Favored 'General case' 0 C--N 1.344 0.341 0 CA-C-N 119.155 0.889 . . . . 0.0 110.535 173.184 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -58.94 -39.38 81.46 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.122 0.873 . . . . 0.0 113.012 176.842 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -58.67 -49.19 78.48 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 118.763 0.71 . . . . 0.0 112.572 177.435 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 45.2 mtm -68.14 -47.38 68.25 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.249 0.62 . . . . 0.0 112.317 175.626 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 69.4 mt -54.52 -47.98 72.48 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.229 1.012 . . . . 0.0 111.034 -178.851 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -59.56 -22.07 61.2 Favored 'General case' 0 N--CA 1.482 1.165 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 175.776 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -88.42 -22.05 23.94 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 125.977 1.711 . . . . 0.0 113.727 173.559 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -111.26 -33.72 6.36 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -170.59 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 42.7 tp . . . . . 0 CA--C 1.54 0.57 0 C-N-CA 126.957 2.103 . . . . 0.0 108.938 169.137 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 . . . . . 0 CA--C 1.547 0.847 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -99.16 30.67 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.988 0 C-N-CA 126.941 2.096 . . . . 0.0 111.711 -176.497 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 53.9 t30 50.43 38.71 18.91 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 126.049 1.74 . . . . 0.0 113.32 -174.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 14.4 pm0 -85.02 168.61 14.76 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.067 1.747 . . . . 0.0 113.099 -173.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 31.1 m -110.1 172.07 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 C-N-CA 126.223 1.809 . . . . 0.0 112.941 -169.797 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 42.7 mtm180 -86.83 143.14 34.99 Favored Pre-proline 0 N--CA 1.48 1.055 0 O-C-N 121.304 -0.873 . . . . 0.0 111.862 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -81.48 -179.28 4.82 Favored 'Trans proline' 0 CA--C 1.535 0.529 0 C-N-CA 124.371 3.381 . . . . 0.0 112.447 173.711 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.9 ttmt -70.38 149.68 47.05 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.034 0.534 . . . . 0.0 109.932 175.061 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 85.4 mt -62.44 -41.76 75.8 Favored Pre-proline 0 N--CA 1.478 0.933 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 -168.634 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -63.33 -29.81 72.76 Favored 'Trans proline' 0 C--N 1.349 0.582 0 CA-C-N 121.58 1.6 . . . . 0.0 114.001 171.202 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 7.9 tp -64.68 -42.01 95.66 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 119.591 1.087 . . . . 0.0 110.549 172.11 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.1 tt -64.34 -35.09 79.73 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.012 0.925 . . . . 0.0 111.792 174.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -66.3 -41.39 89.83 Favored 'General case' 0 N--CA 1.483 1.219 0 O-C-N 120.954 -1.091 . . . . 0.0 113.089 170.159 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 74.5 mt -62.46 -39.0 82.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 CA-C-N 119.413 1.006 . . . . 0.0 111.179 173.325 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 52.4 mt -65.3 -42.12 93.4 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.083 0.953 . . . . 0.0 111.919 173.538 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 34.4 m170 -61.56 -41.13 96.93 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.15 -0.969 . . . . 0.0 112.172 171.626 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.54 -27.52 69.02 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.89 0.876 . . . . 0.0 112.964 176.075 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.449 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -74.66 -3.55 31.98 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.303 1.041 . . . . 0.0 113.515 172.157 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 92.28 6.83 64.3 Favored Glycine 0 CA--C 1.537 1.449 0 C-N-CA 125.542 1.544 . . . . 0.0 114.821 -178.438 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -85.49 168.34 14.63 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 118.745 1.272 . . . . 0.0 113.327 179.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 22.2 tm0? -135.36 140.89 45.39 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.712 1.605 . . . . 0.0 108.157 168.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 175.03 172.93 40.39 Favored Glycine 0 CA--C 1.526 0.73 0 N-CA-C 115.512 0.965 . . . . 0.0 115.512 -176.611 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -133.23 -58.25 0.9 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 126.227 1.811 . . . . 0.0 109.889 173.356 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 21.5 mtm -95.62 137.26 34.93 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.049 1.739 . . . . 0.0 111.568 175.493 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 84.6 m-85 -150.45 138.4 20.08 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.719 1.208 . . . . 0.0 112.532 -178.248 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 51.1 p -81.94 169.57 16.63 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.164 0.986 . . . . 0.0 110.477 168.172 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -56.39 -36.59 47.51 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 O-C-N 120.459 -1.401 . . . . 0.0 111.434 172.752 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 54.9 tptt -68.03 -44.79 75.68 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.726 1.211 . . . . 0.0 112.56 176.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 58.5 mt-10 -66.1 -36.81 84.16 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.206 0.602 . . . . 0.0 112.014 176.308 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 66.8 t -61.87 -50.37 80.43 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 C-N-CA 123.25 0.62 . . . . 0.0 110.409 170.198 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.35 -39.16 93.78 Favored 'General case' 0 C--N 1.334 -0.094 0 C-N-CA 126.261 1.824 . . . . 0.0 114.279 -172.338 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 83.1 t60 -51.59 -52.57 46.44 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 122.732 0.413 . . . . 0.0 111.309 174.361 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -74.79 -32.68 62.07 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 115.103 1.519 . . . . 0.0 115.103 174.379 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -70.25 -40.68 74.28 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 120.779 1.627 . . . . 0.0 112.89 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -60.62 -47.35 91.59 Favored Glycine 0 CA--C 1.53 0.978 0 N-CA-C 110.914 -0.875 . . . . 0.0 110.914 171.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 11.6 tp60 -57.17 -42.37 80.98 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.296 1.038 . . . . 0.0 112.503 173.22 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.449 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 71.3 t80 -63.96 -51.54 63.87 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.817 1.247 . . . . 0.0 110.784 178.648 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 37.1 mt -61.66 -37.74 78.69 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 C-N-CA 123.869 0.868 . . . . 0.0 110.793 178.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 34.9 mmt -66.73 -43.16 84.93 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 174.047 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 7.4 p -78.49 -28.6 14.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 CA-C-N 119.894 1.225 . . . . 0.0 113.386 -176.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 20.2 mmtp -91.13 -15.81 28.81 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.052 1.341 . . . . 0.0 113.458 173.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 14.6 mp0 54.18 63.34 2.21 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.078 1.751 . . . . 0.0 112.707 -174.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 13.6 tp -92.3 12.59 21.97 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.047 1.339 . . . . 0.0 111.961 -178.706 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 32.9 p90 -123.02 160.68 25.8 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 128.482 2.713 . . . . 0.0 110.625 -177.115 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.2 t0 -92.82 128.61 38.75 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 169.392 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.27 -30.95 52.4 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 179.709 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -94.11 -16.41 23.8 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.004 1.322 . . . . 0.0 112.559 -172.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -139.57 59.46 1.59 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 127.43 2.292 . . . . 0.0 109.83 -177.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -63.23 -17.75 62.79 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.526 0.73 . . . . 0.0 111.961 -178.546 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 6.4 p-80 -63.91 -1.39 1.41 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.353 1.461 . . . . 0.0 113.429 168.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 36.3 mtp -128.03 145.43 50.99 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 120.293 1.406 . . . . 0.0 111.618 168.209 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.7 t -127.36 140.26 49.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 125.484 1.514 . . . . 0.0 108.208 173.417 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 -112.74 52.61 0.77 Allowed 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.378 1.071 . . . . 0.0 113.818 -168.511 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 32.6 m -70.5 1.73 4.78 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -176.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.57 -25.45 55.36 Favored Glycine 0 CA--C 1.541 1.69 0 CA-C-N 120.558 1.527 . . . . 0.0 114.185 169.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -89.26 5.87 83.86 Favored Glycine 0 CA--C 1.542 1.727 0 C-N-CA 125.375 1.464 . . . . 0.0 115.327 171.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -109.46 172.36 6.9 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.335 1.854 . . . . 0.0 112.058 -174.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 88.5 mt -55.02 -35.62 64.62 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 120.986 -1.071 . . . . 0.0 112.352 169.35 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.1 tp -60.46 -42.58 96.49 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.738 0.815 . . . . 0.0 111.116 174.311 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -65.92 -44.36 91.95 Favored Glycine 0 CA--C 1.529 0.937 0 C-N-CA 125.378 1.466 . . . . 0.0 113.627 172.17 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.2 -26.91 65.96 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.376 1.588 . . . . 0.0 112.356 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 28.2 tp -71.83 -54.56 9.77 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.036 1.334 . . . . 0.0 111.996 169.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -88.64 -5.15 58.34 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-N 118.771 0.714 . . . . 0.0 112.71 -170.613 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 78.69 -27.89 2.17 Favored Glycine 0 CA--C 1.54 1.605 0 C-N-CA 126.131 1.824 . . . . 0.0 113.291 -170.045 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.81 134.85 9.0 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 128.28 2.632 . . . . 0.0 109.741 176.317 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -145.17 28.39 1.22 Allowed 'General case' 0 N--CA 1.476 0.863 0 O-C-N 121.3 -0.875 . . . . 0.0 110.876 174.726 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 14.9 m -87.92 135.61 33.33 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 121.59 -0.694 . . . . 0.0 109.387 170.631 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 17.5 p90 -158.26 168.75 26.18 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 123.84 0.856 . . . . 0.0 113.215 -169.255 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 14.9 t -110.26 136.19 49.84 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 122.373 1.082 . . . . 0.0 112.217 170.5 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -78.09 -13.66 13.93 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-N 114.08 -1.418 . . . . 0.0 114.115 -171.321 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 47.5 pttt -81.26 -7.31 59.55 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 125.867 1.667 . . . . 0.0 115.034 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -119.36 85.22 30.66 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 126.07 1.748 . . . . 0.0 110.828 -172.438 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.25 -27.32 56.15 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.953 3.102 . . . . 0.0 115.261 -172.122 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 68.2 m -63.59 -55.89 30.8 Favored Pre-proline 0 N--CA 1.478 0.928 0 CA-C-N 119.924 1.238 . . . . 0.0 114.036 -177.463 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -66.81 -29.55 42.01 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 121.872 1.715 . . . . 0.0 112.341 175.407 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 25.4 tp -65.48 -43.05 91.46 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.069 0.948 . . . . 0.0 111.583 176.699 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -60.49 -39.56 88.14 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 121.702 -0.624 . . . . 0.0 111.968 173.252 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -61.68 -43.28 99.16 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.244 0.618 . . . . 0.0 112.521 176.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 38.2 mtm -64.04 -49.83 70.84 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 173.059 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 65.7 mt -53.25 -48.16 68.46 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.886 1.274 . . . . 0.0 110.855 177.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.64 -18.51 12.38 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.745 1.618 . . . . 0.0 114.881 176.371 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -96.9 -22.51 16.84 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 125.955 1.702 . . . . 0.0 114.0 172.362 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -105.28 -26.98 11.79 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 119.818 1.19 . . . . 0.0 113.808 -175.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 3.0 tt -113.94 105.99 13.9 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.817 1.647 . . . . 0.0 106.937 169.062 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 44.9 t -61.31 125.23 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 C-N-CA 123.626 0.77 . . . . 0.0 110.405 -172.437 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 1.7 t -152.64 -174.33 4.87 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.597 1.159 . . . . 0.0 111.771 -177.119 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -75.44 -144.14 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.893 2.077 . . . . 0.0 110.594 171.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . 65.83 170.66 0.22 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 125.89 1.676 . . . . 0.0 115.306 -177.479 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 19.9 p . . . . . 0 N--CA 1.482 1.134 0 C-N-CA 127.124 2.17 . . . . 0.0 113.788 -177.457 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 200' ' ' 44Z . . . . . 0.43 ' CD3' ' CG1' ' A' ' 200' ' ' 44Z . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 21.8 pt20 . . . . . 0 CA--C 1.544 0.749 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -121.06 149.96 24.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 125.601 1.56 . . . . 0.0 110.222 -179.642 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -77.83 56.77 1.58 Allowed 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 124.991 1.317 . . . . 0.0 112.016 175.67 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -138.38 -179.4 5.78 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 128.092 2.557 . . . . 0.0 110.529 -170.581 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 23.6 m -103.73 156.29 5.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 124.759 1.224 . . . . 0.0 111.778 -176.319 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 30.8 ttt180 -101.31 123.24 45.41 Favored Pre-proline 0 N--CA 1.476 0.848 0 C-N-CA 124.651 1.181 . . . . 0.0 110.503 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.0 162.31 40.48 Favored 'Trans proline' 0 CA--C 1.535 0.553 0 C-N-CA 123.061 2.507 . . . . 0.0 113.197 170.414 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.3 tpmt? -61.38 150.42 35.3 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.476 1.11 . . . . 0.0 110.121 175.617 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 88.3 mt -60.73 -41.6 83.36 Favored Pre-proline 0 N--CA 1.478 0.936 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -170.28 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -65.09 -26.7 57.68 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 121.952 1.768 . . . . 0.0 114.02 172.686 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.2 tt -72.49 -45.91 57.24 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.06 0.944 . . . . 0.0 109.988 172.508 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.3 tt -57.79 -33.57 68.69 Favored 'General case' 0 N--CA 1.477 0.919 0 O-C-N 120.782 -1.199 . . . . 0.0 112.237 173.452 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.75 -28.14 69.76 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 113.742 1.015 . . . . 0.0 113.742 170.935 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 68.8 mt -67.33 -45.93 84.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 CA-C-N 119.74 1.155 . . . . 0.0 110.319 171.526 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.03 -40.66 90.08 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.275 0.63 . . . . 0.0 111.015 176.142 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.8 m170 -64.99 -42.74 94.25 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.758 -0.589 . . . . 0.0 112.51 173.024 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.34 -28.97 70.07 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.15 -0.969 . . . . 0.0 112.983 176.5 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.442 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -73.46 -6.08 44.1 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.428 1.091 . . . . 0.0 113.308 172.886 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.66 7.58 64.67 Favored Glycine 0 CA--C 1.537 1.464 0 C-N-CA 125.374 1.464 . . . . 0.0 115.129 -179.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -88.21 167.58 13.47 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 118.752 1.276 . . . . 0.0 112.745 177.128 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.8 tm0? -126.71 141.78 51.74 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.286 1.434 . . . . 0.0 109.551 169.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 174.92 167.5 34.29 Favored Glycine 0 N--CA 1.465 0.629 0 N-CA-C 114.726 0.65 . . . . 0.0 114.726 -178.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -126.8 -59.68 1.26 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.57 1.548 . . . . 0.0 109.734 170.016 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.0 mpp? -93.72 139.98 30.19 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 126.079 1.752 . . . . 0.0 111.126 170.436 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -146.53 138.97 25.08 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.425 1.49 . . . . 0.0 111.506 178.083 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 41.1 p -74.25 170.52 15.41 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 121.274 -0.891 . . . . 0.0 110.911 168.473 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.9 t -55.43 -40.53 58.39 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 120.349 -1.469 . . . . 0.0 110.891 169.361 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -66.96 -43.63 82.63 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.314 1.046 . . . . 0.0 112.695 179.212 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 64.6 mt-10 -69.79 -33.48 72.44 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 176.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 52.2 t -61.93 -54.87 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 CA-C-N 118.663 0.665 . . . . 0.0 109.49 169.53 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.3 ttm -61.75 -37.26 83.6 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 126.941 2.096 . . . . 0.0 114.586 -173.388 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -51.7 -55.19 21.01 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.154 0.582 . . . . 0.0 111.827 172.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 60.0 m-85 -74.82 -30.0 61.25 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 174.338 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -71.67 -39.65 70.15 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 120.277 1.399 . . . . 0.0 112.677 -179.649 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.16 -39.87 98.21 Favored Glycine 0 CA--C 1.533 1.202 0 CA-C-N 119.395 0.998 . . . . 0.0 111.959 171.633 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 9.9 tp60 -64.57 -45.74 85.78 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.023 1.329 . . . . 0.0 112.215 172.784 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.442 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 57.2 t80 -61.35 -49.54 76.55 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 124.21 1.004 . . . . 0.0 109.901 178.125 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 56.7 mt -64.38 -33.63 64.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 C-N-CA 124.322 1.049 . . . . 0.0 111.032 178.248 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 5.5 tpt -63.46 -39.23 93.9 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 120.23 1.377 . . . . 0.0 112.127 169.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 99.3 t -78.17 -41.53 26.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 O-C-N 120.429 -1.419 . . . . 0.0 112.584 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 52.7 mmtt -85.97 -15.71 40.66 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.082 1.353 . . . . 0.0 112.654 -176.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 48.02 81.29 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 128.558 2.743 . . . . 0.0 114.307 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 37.0 mt -101.86 8.71 41.17 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 125.194 1.398 . . . . 0.0 113.381 -177.794 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 50.3 p90 -122.58 164.02 18.94 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.325 1.85 . . . . 0.0 111.456 -175.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -91.32 133.46 35.41 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.79 -0.569 . . . . 0.0 111.369 174.232 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.2 -20.92 60.85 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 120.902 -1.124 . . . . 0.0 113.902 173.873 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -81.79 -32.03 31.53 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.543 1.137 . . . . 0.0 111.157 179.635 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -146.2 74.4 1.37 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 127.604 2.361 . . . . 0.0 110.311 -169.529 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 29.1 mp0 -60.41 -23.9 64.73 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 120.859 -1.151 . . . . 0.0 112.58 178.126 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 5.6 p-80 -67.4 -6.91 21.28 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.385 1.474 . . . . 0.0 114.502 171.065 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 1.9 tpt -111.98 126.77 55.5 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 126.749 2.02 . . . . 0.0 109.726 173.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.4 t -126.07 133.77 68.1 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.766 1.227 . . . . 0.0 110.062 -178.113 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -118.51 100.12 7.25 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.929 1.692 . . . . 0.0 109.086 173.018 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 61.4 m -99.43 14.51 29.51 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.509 0.724 . . . . 0.0 112.737 175.204 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.19 -27.25 68.77 Favored Glycine 0 CA--C 1.538 1.527 0 O-C-N 120.639 -1.288 . . . . 0.0 114.518 -177.656 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -90.03 4.61 83.17 Favored Glycine 0 CA--C 1.54 1.639 0 C-N-CA 125.145 1.355 . . . . 0.0 114.995 172.095 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -106.89 172.01 7.05 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.772 1.629 . . . . 0.0 112.669 -174.269 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 10.9 mp -53.45 -34.12 56.68 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.396 1.478 . . . . 0.0 112.663 169.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 98.7 mt -61.08 -47.15 87.67 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 121.111 -0.993 . . . . 0.0 111.654 170.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -63.3 -38.6 96.7 Favored Glycine 0 CA--C 1.533 1.171 0 CA-C-O 119.16 -0.8 . . . . 0.0 112.889 173.247 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.65 -29.66 62.47 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 119.715 1.758 . . . . 0.0 112.973 -179.497 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.1 pp -81.4 -34.72 31.45 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 175.431 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -100.4 -9.68 21.96 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 119.17 0.895 . . . . 0.0 113.15 -177.404 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.49 -27.1 3.33 Favored Glycine 0 CA--C 1.54 1.634 0 C-N-CA 125.525 1.536 . . . . 0.0 112.905 -169.298 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.68 138.36 6.05 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 128.032 2.533 . . . . 0.0 111.282 178.512 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -144.21 69.2 1.27 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.836 0.854 . . . . 0.0 109.149 168.873 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -105.02 124.88 50.3 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 169.421 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 49.8 p90 -157.22 156.03 31.85 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.18 0.992 . . . . 0.0 112.118 -169.32 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 10.5 m -107.65 135.8 48.48 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.076 171.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . 0.264 0.2 OUTLIER -78.23 -14.5 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 -169.412 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -75.5 -7.9 55.33 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 125.562 1.545 . . . . 0.0 114.832 174.309 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -116.67 95.35 45.97 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 126.719 2.008 . . . . 0.0 110.334 -172.708 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -62.45 -28.36 77.91 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.965 3.11 . . . . 0.0 115.249 -178.039 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 67.3 m -58.85 -53.89 61.84 Favored Pre-proline 0 N--CA 1.477 0.885 0 CA-C-N 120.121 1.328 . . . . 0.0 113.834 -178.576 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -65.52 -28.31 53.56 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 122.099 1.866 . . . . 0.0 113.187 174.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.54 HD22 ' CE3' ' A' ' 200' ' ' 44Z . 49.4 mt -62.92 -50.89 69.07 Favored 'General case' 0 C--N 1.344 0.356 0 CA-C-N 119.6 1.091 . . . . 0.0 111.13 174.009 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -60.48 -40.84 92.76 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 118.883 -0.579 . . . . 0.0 112.146 174.759 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -61.46 -49.65 75.97 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 119.229 0.922 . . . . 0.0 112.845 179.173 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 31.4 mtm -60.78 -49.64 76.67 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.657 0.783 . . . . 0.0 112.211 175.504 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 10.2 mp -65.97 -42.38 89.96 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 118.542 -0.742 . . . . 0.0 111.814 -176.433 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -57.28 -20.27 27.0 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 119.835 1.198 . . . . 0.0 113.842 172.302 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 90.4 mttt -95.84 -13.87 23.68 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.77 1.628 . . . . 0.0 114.404 174.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 8.1 p-10 -124.8 -16.33 6.21 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 116.154 1.909 . . . . 0.0 116.154 -178.049 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 57.4 tp -119.86 137.7 53.84 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 127.358 2.263 . . . . 0.0 108.858 176.434 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 91.4 t -68.73 104.57 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 173.081 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 4.8 t -156.98 -179.56 8.34 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.722 1.609 . . . . 0.0 110.975 -178.373 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -97.29 160.43 14.33 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.743 1.217 . . . . 0.0 113.466 -172.261 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -101.57 174.97 5.72 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.817 2.047 . . . . 0.0 114.024 -169.798 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 13.0 t . . . . . 0 N--CA 1.483 1.218 0 C-N-CA 127.271 2.229 . . . . 0.0 114.865 177.817 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 200' ' ' 44Z . . . . . 0.54 ' CE3' HD22 ' A' ' 98' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 . . . . . 0 CA--C 1.543 0.693 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.1 mt -130.31 14.89 2.22 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 125.052 1.341 . . . . 0.0 111.392 -175.347 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 49.46 39.02 15.69 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 126.115 1.766 . . . . 0.0 113.032 -175.446 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.1 pm0 -82.52 179.18 7.88 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.237 1.415 . . . . 0.0 113.708 -172.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 32.6 m -117.37 172.06 5.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 C-N-CA 126.744 2.017 . . . . 0.0 111.847 -175.176 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 24.0 ttp-105 -99.49 134.47 21.15 Favored Pre-proline 0 N--CA 1.481 1.111 0 O-C-N 120.847 -1.158 . . . . 0.0 111.802 178.692 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -71.46 171.29 16.51 Favored 'Trans proline' 0 C--N 1.354 0.832 0 C-N-CA 123.624 2.883 . . . . 0.0 112.65 175.437 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.6 tpmt? -62.01 146.66 49.52 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.251 1.02 . . . . 0.0 110.739 178.271 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 90.2 mt -55.3 -49.22 93.64 Favored Pre-proline 0 N--CA 1.474 0.769 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 -173.742 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -65.11 -21.09 63.22 Favored 'Trans proline' 0 CA--C 1.54 0.807 0 CA-C-N 122.034 1.762 . . . . 0.0 113.856 177.599 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.2 tt -75.72 -46.36 31.52 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.247 0.93 . . . . 0.0 109.657 169.472 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.1 tp -57.01 -34.62 68.36 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.246 -0.909 . . . . 0.0 113.285 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -64.3 -22.4 66.94 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 121.271 -0.893 . . . . 0.0 113.34 175.195 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 51.7 mt -70.23 -39.67 77.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 123.93 0.892 . . . . 0.0 110.363 171.595 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.9 mp -70.01 -35.37 74.31 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.347 -0.846 . . . . 0.0 111.279 175.375 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 57.7 m170 -61.03 -46.32 91.23 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 118.208 0.458 . . . . 0.0 111.263 169.619 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.65 -24.68 67.89 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 175.443 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.415 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -71.58 -6.31 39.81 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 172.054 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.72 17.59 47.98 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 125.039 1.304 . . . . 0.0 115.069 177.493 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -121.13 150.01 41.91 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.043 1.337 . . . . 0.0 112.71 -179.08 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -74.46 171.12 14.34 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.486 0.714 . . . . 0.0 111.548 169.655 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -169.06 133.1 2.74 Favored Glycine 0 C--N 1.341 0.817 0 N-CA-C 117.487 1.755 . . . . 0.0 117.487 -178.329 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -140.56 -13.41 0.99 Allowed 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 173.678 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 3.2 mtm -171.04 134.08 0.92 Allowed 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 126.539 1.936 . . . . 0.0 111.391 -175.337 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -155.1 147.5 24.0 Favored 'General case' 0 CA--C 1.55 0.974 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 -173.094 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 50.7 p -94.97 171.84 8.51 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 127.106 2.162 . . . . 0.0 110.371 168.234 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -52.09 -48.02 42.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 CA-C-N 120.356 1.435 . . . . 0.0 110.428 169.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -53.32 -37.84 62.65 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.114 0.966 . . . . 0.0 113.091 -179.46 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -80.82 -42.98 20.75 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.248 1.019 . . . . 0.0 112.726 176.088 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 75.6 t -64.18 -48.32 86.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 O-C-N 120.851 -1.156 . . . . 0.0 111.775 -179.384 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.4 mmm -72.66 -25.8 61.4 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 118.906 0.775 . . . . 0.0 112.421 -174.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 77.1 t60 -60.56 -54.52 44.44 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.678 0.791 . . . . 0.0 110.804 169.575 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 53.6 m-85 -72.37 -32.62 66.58 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 113.58 0.955 . . . . 0.0 113.58 179.404 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.9 mp -69.91 -40.64 75.48 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.882 1.219 . . . . 0.0 112.197 172.316 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.22 -42.91 99.72 Favored Glycine 0 CA--C 1.529 0.959 0 CA-C-N 118.979 0.809 . . . . 0.0 111.847 172.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.8 tp-100 -58.52 -47.03 85.51 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.554 1.141 . . . . 0.0 111.973 171.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.415 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 28.3 t80 -60.7 -49.59 76.9 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.323 0.649 . . . . 0.0 110.752 175.799 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 54.6 mt -57.68 -37.83 61.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 124.868 1.267 . . . . 0.0 111.125 177.428 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -69.24 -37.56 78.05 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.876 0.87 . . . . 0.0 113.136 174.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 81.4 t -78.23 -31.5 16.34 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 124.179 0.992 . . . . 0.0 112.524 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 54.3 mmtt -92.34 -14.72 28.32 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.894 1.278 . . . . 0.0 113.152 176.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.7 mp0 53.61 61.16 3.24 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.467 1.907 . . . . 0.0 113.134 -172.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.4 mp -95.69 6.16 49.62 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.003 1.321 . . . . 0.0 113.539 -179.728 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 52.4 p90 -89.88 158.95 17.2 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.823 1.649 . . . . 0.0 110.691 169.603 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -85.27 123.37 30.67 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.589 -0.694 . . . . 0.0 110.904 170.581 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.4 -22.07 66.74 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 120.895 -1.128 . . . . 0.0 112.865 178.61 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 48.2 mm-40 -78.7 -26.94 44.92 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.357 -0.839 . . . . 0.0 111.035 -176.596 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -160.25 83.71 0.71 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 127.189 2.196 . . . . 0.0 110.906 -171.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -60.58 -14.24 18.96 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.626 1.57 . . . . 0.0 115.089 -169.752 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 22.6 p80 -65.31 -23.44 67.02 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 118.112 -0.947 . . . . 0.0 113.082 171.601 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 42.3 mmm -83.88 139.91 32.32 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 119.67 1.123 . . . . 0.0 112.843 173.424 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 60.4 t -120.86 133.45 67.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 127.794 2.437 . . . . 0.0 107.0 169.73 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 10.5 t80 -121.38 13.34 11.04 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 116.833 2.161 . . . . 0.0 116.833 -168.391 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 15.9 p 39.06 31.33 0.05 OUTLIER 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 128.407 2.683 . . . . 0.0 117.542 175.418 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.34 108.34 1.89 Allowed Glycine 0 CA--C 1.534 1.269 0 O-C-N 120.897 -1.127 . . . . 0.0 113.348 -171.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 68.45 14.06 66.29 Favored Glycine 0 CA--C 1.54 1.62 0 C-N-CA 124.21 0.91 . . . . 0.0 114.895 -175.37 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -75.45 155.27 36.45 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 118.682 1.241 . . . . 0.0 112.265 -177.186 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 81.8 mt -62.53 -32.5 73.46 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.412 1.485 . . . . 0.0 111.56 169.31 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 84.8 mt -54.81 -48.04 73.3 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.7 0.8 . . . . 0.0 111.354 171.73 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -71.78 -38.76 60.66 Favored Glycine 0 CA--C 1.53 0.976 0 C-N-CA 124.42 1.009 . . . . 0.0 112.989 178.032 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.93 -26.62 65.17 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 119.673 1.736 . . . . 0.0 112.481 177.457 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 47.7 tp -76.12 -56.32 4.76 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.397 1.479 . . . . 0.0 112.181 173.297 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.31 -7.73 41.01 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 113.469 0.915 . . . . 0.0 113.469 -169.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 80.66 -25.64 3.34 Favored Glycine 0 CA--C 1.539 1.558 0 C-N-CA 125.756 1.646 . . . . 0.0 113.34 -169.675 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.6 137.2 11.03 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 126.801 2.041 . . . . 0.0 112.058 178.264 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -148.14 49.06 1.05 Allowed 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.686 1.195 . . . . 0.0 110.429 168.653 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 8.1 p -89.85 137.53 32.26 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 121.327 -0.858 . . . . 0.0 110.063 169.155 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 46.6 p90 -171.82 167.95 6.2 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.519 0.728 . . . . 0.0 112.064 -169.151 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 60.2 p -121.21 143.83 48.93 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.071 -0.968 . . . . 0.0 113.51 173.131 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.505 HG21 ' CE5' ' A' ' 200' ' ' 44Z . 27.1 m -74.39 -12.86 15.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 -179.218 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.39 -0.48 46.2 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.778 1.631 . . . . 0.0 114.586 170.5 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 40.8 t0 -126.85 77.39 74.65 Favored Pre-proline 0 CA--C 1.551 1.015 0 C-N-CA 127.135 2.174 . . . . 0.0 109.95 171.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_exo -56.64 -40.88 81.33 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 124.623 3.549 . . . . 0.0 114.882 -175.531 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 55.6 m -52.92 -54.86 39.24 Favored Pre-proline 0 N--CA 1.476 0.848 0 N-CA-C 114.838 1.421 . . . . 0.0 114.838 -172.388 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -65.81 -30.46 49.62 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 122.336 2.024 . . . . 0.0 113.425 175.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.45 ' HA ' ' HE2' ' A' ' 101' ' ' MET . 37.0 tp -66.95 -47.28 72.13 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.003 0.921 . . . . 0.0 110.672 176.103 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -58.23 -40.53 81.93 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.721 0.808 . . . . 0.0 112.228 171.341 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -60.11 -51.04 71.31 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 119.729 1.15 . . . . 0.0 112.902 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.45 ' HE2' ' HA ' ' A' ' 98' ' ' LEU . 64.7 mtm -63.6 -44.5 93.8 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.034 0.534 . . . . 0.0 112.116 175.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 66.4 mt -61.5 -46.74 88.73 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-O 117.732 -1.128 . . . . 0.0 111.326 178.573 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 42.1 ttt180 -56.37 -24.98 47.9 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 121.265 1.848 . . . . 0.0 113.547 174.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -85.17 -17.9 35.77 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.561 1.544 . . . . 0.0 114.012 174.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -123.36 -6.39 8.22 Favored 'General case' 0 CA--C 1.558 1.273 0 N-CA-C 115.698 1.74 . . . . 0.0 115.698 178.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 68.8 tp -142.51 144.94 33.19 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 128.512 2.725 . . . . 0.0 109.679 -174.079 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 41.8 t -75.97 96.15 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 172.075 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 6.3 t -152.2 -174.62 4.94 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.404 1.482 . . . . 0.0 111.584 -177.155 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -101.52 175.58 5.52 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.467 1.907 . . . . 0.0 112.395 -171.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -109.13 -169.55 1.5 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.839 1.656 . . . . 0.0 112.999 -177.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 54.4 p . . . . . 0 N--CA 1.475 0.785 0 C-N-CA 126.137 1.775 . . . . 0.0 113.66 177.023 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 200' ' ' 44Z . . . . . 0.505 ' CE5' HG21 ' A' ' 92' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 . . . . . 0 CA--C 1.543 0.706 0 N-CA-C 112.292 0.478 . . . . 0.0 112.292 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 50.9 mt -129.09 136.95 58.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 125.408 1.483 . . . . 0.0 110.492 -175.404 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.0 t30 -112.0 123.39 50.16 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.456 1.502 . . . . 0.0 108.856 169.334 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.1 pm0 -147.2 -179.68 7.0 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 -168.695 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 33.7 m -104.14 172.18 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 C-N-CA 127.126 2.17 . . . . 0.0 111.656 175.289 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.3 ttp-105 -95.42 133.66 25.55 Favored Pre-proline 0 N--CA 1.48 1.037 0 O-C-N 120.991 -1.068 . . . . 0.0 111.522 172.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -68.38 171.44 12.88 Favored 'Trans proline' 0 C--N 1.354 0.857 0 C-N-CA 123.799 3.0 . . . . 0.0 113.501 176.05 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.5 ttmt -62.86 149.62 43.9 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.142 0.977 . . . . 0.0 110.685 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 81.3 mt -61.66 -43.11 87.12 Favored Pre-proline 0 N--CA 1.476 0.866 0 N-CA-C 115.062 1.504 . . . . 0.0 115.062 -168.536 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -65.0 -28.41 57.66 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.035 1.824 . . . . 0.0 113.752 172.268 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 5.1 tt -67.49 -49.19 64.63 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 119.221 0.919 . . . . 0.0 109.499 172.449 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 13.9 tp -60.24 -33.07 71.77 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 121.294 -0.879 . . . . 0.0 112.784 177.41 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -58.66 -27.69 65.02 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 174.048 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 60.0 mt -72.99 -39.13 57.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.17 0.988 . . . . 0.0 110.998 175.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.3 mp -68.08 -34.85 77.19 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.477 -0.764 . . . . 0.0 110.953 174.132 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 60.4 m170 -61.94 -44.58 96.47 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 121.998 -0.439 . . . . 0.0 111.513 169.556 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -65.02 -26.99 68.51 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 175.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.33 -3.41 26.97 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.352 1.061 . . . . 0.0 113.435 171.67 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.67 15.26 57.02 Favored Glycine 0 CA--C 1.535 1.317 0 C-N-CA 125.021 1.296 . . . . 0.0 115.309 174.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -117.13 145.34 43.86 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.943 1.297 . . . . 0.0 112.551 -179.114 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -75.06 170.69 15.51 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.255 0.622 . . . . 0.0 111.329 169.461 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -173.0 143.74 7.44 Favored Glycine 0 C--N 1.34 0.765 0 N-CA-C 117.324 1.69 . . . . 0.0 117.324 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -140.7 -11.22 1.02 Allowed 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 175.519 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.5 mtm -169.68 130.18 1.03 Allowed 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 125.744 1.618 . . . . 0.0 111.579 -175.479 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -155.82 139.5 16.06 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -175.56 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 64.8 p -80.77 176.02 10.17 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.792 0.837 . . . . 0.0 109.646 166.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -59.34 -37.64 70.41 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.324 0 O-C-N 120.262 -1.524 . . . . 0.0 111.651 172.381 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -66.97 -42.19 85.57 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.865 1.666 . . . . 0.0 113.059 175.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -70.34 -35.06 73.36 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.776 -0.577 . . . . 0.0 112.094 174.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 18.7 t -60.38 -48.91 86.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 124.085 0.954 . . . . 0.0 110.844 169.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -62.34 -36.43 82.16 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 127.097 2.159 . . . . 0.0 114.178 -173.176 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -51.7 -53.02 43.74 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 122.857 0.463 . . . . 0.0 111.956 170.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -74.7 -31.66 61.94 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 114.296 1.221 . . . . 0.0 114.296 175.684 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -72.14 -41.93 66.58 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.971 1.26 . . . . 0.0 112.876 -179.324 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -60.46 -42.94 99.22 Favored Glycine 0 CA--C 1.532 1.126 0 CA-C-N 118.826 0.739 . . . . 0.0 111.559 171.261 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.2 tp60 -61.61 -42.26 98.63 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.77 1.228 . . . . 0.0 112.648 173.287 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -64.45 -51.88 60.83 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.307 1.043 . . . . 0.0 110.42 177.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 55.8 mt -60.85 -37.4 76.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 O-C-N 121.501 -0.749 . . . . 0.0 110.597 179.324 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.2 tpt -63.88 -46.57 84.33 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.88 1.272 . . . . 0.0 112.892 173.59 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.3 p -78.5 -27.24 14.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 CA-C-N 119.73 1.15 . . . . 0.0 113.683 -176.417 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 55.0 mmtt -90.48 -15.72 30.27 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 125.074 1.349 . . . . 0.0 113.365 173.212 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.4 mp0 54.35 60.08 3.79 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 127.034 2.134 . . . . 0.0 113.105 -174.192 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.9 tp -95.62 6.18 49.6 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.08 0.952 . . . . 0.0 113.301 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 47.4 p90 -95.68 159.8 14.81 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 126.109 1.763 . . . . 0.0 111.022 173.476 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -86.07 129.24 34.9 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.518 -0.739 . . . . 0.0 111.836 172.483 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.35 -24.26 66.48 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 120.799 -1.188 . . . . 0.0 112.752 176.536 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 49.7 mm-40 -78.68 -30.57 46.23 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.28 -0.887 . . . . 0.0 110.756 -176.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -151.72 80.58 1.28 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 128.036 2.534 . . . . 0.0 110.159 -169.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 27.2 mp0 -60.76 -15.54 30.67 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 114.292 1.219 . . . . 0.0 114.292 -174.494 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 21.6 p80 -64.31 -22.51 66.98 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 118.402 -0.809 . . . . 0.0 113.113 171.548 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.8 ttm -96.88 137.27 36.23 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 119.838 1.199 . . . . 0.0 112.783 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 52.7 t -132.06 138.32 52.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 126.419 1.888 . . . . 0.0 110.18 -179.342 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -104.16 51.02 0.78 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.934 1.293 . . . . 0.0 113.889 -171.007 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 90.4 m -69.39 -1.61 8.82 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 115.321 1.6 . . . . 0.0 115.321 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.36 -25.19 60.1 Favored Glycine 0 CA--C 1.539 1.578 0 CA-C-N 120.462 1.483 . . . . 0.0 113.686 169.525 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -91.57 9.96 75.84 Favored Glycine 0 CA--C 1.54 1.653 0 C-N-CA 125.506 1.526 . . . . 0.0 115.064 170.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -119.6 174.83 6.17 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.539 1.536 . . . . 0.0 112.689 -173.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -49.84 -40.17 41.32 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.004 1.722 . . . . 0.0 111.933 176.474 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 63.1 mt -62.56 -38.12 88.83 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 120.746 0.307 . . . . 0.0 111.155 178.145 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -79.12 -29.09 52.16 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 125.381 1.467 . . . . 0.0 113.593 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -67.47 -42.23 83.33 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 120.491 2.145 . . . . 0.0 109.606 169.255 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 24.1 tp -60.66 -48.46 81.69 Favored 'General case' 0 CA--C 1.552 1.023 0 CA-C-N 114.974 -1.012 . . . . 0.0 112.76 177.32 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 8.1 mt -94.17 -7.39 42.42 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 116.044 1.868 . . . . 0.0 116.044 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.81 -16.33 11.93 Favored Glycine 0 CA--C 1.543 1.836 0 O-C-N 120.701 -1.249 . . . . 0.0 113.797 -169.655 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.23 155.35 26.88 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 129.024 2.93 . . . . 0.0 109.322 173.89 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -164.03 25.57 0.07 Allowed 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 119.229 0.922 . . . . 0.0 112.215 169.294 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 17.2 m -84.97 132.01 34.41 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 120.999 -1.063 . . . . 0.0 108.681 175.425 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 6.3 p90 -161.26 178.57 9.11 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 -167.442 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 96.7 p -122.88 137.67 54.87 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 114.423 -1.262 . . . . 0.0 113.314 173.72 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.605 HG21 ' CD5' ' A' ' 200' ' ' 44Z . 15.3 m -73.74 -17.05 17.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 -173.399 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.7 pttt -82.53 -6.31 59.25 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.039 1.736 . . . . 0.0 115.046 -177.699 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -118.73 83.33 22.1 Favored Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 126.119 1.768 . . . . 0.0 110.585 -173.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.28 -30.69 54.1 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 124.083 3.189 . . . . 0.0 115.315 -169.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 66.9 m -61.72 -53.96 55.95 Favored Pre-proline 0 N--CA 1.475 0.817 0 CA-C-N 119.698 1.136 . . . . 0.0 113.995 -176.53 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -69.37 -28.38 27.18 Favored 'Trans proline' 0 C--N 1.354 0.818 0 C-N-CA 121.869 1.713 . . . . 0.0 112.764 175.109 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 18.7 tp -66.77 -44.51 81.19 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.884 1.274 . . . . 0.0 111.914 179.263 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -55.48 -39.09 69.98 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.8 1.24 . . . . 0.0 112.947 176.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -59.7 -47.18 86.67 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.717 0.807 . . . . 0.0 112.396 177.393 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 16.7 mtm -69.21 -41.85 76.54 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 178.192 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 65.9 mt -55.34 -54.96 37.06 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.441 1.096 . . . . 0.0 110.588 175.175 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 72.7 ttt180 -52.44 -31.97 37.17 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.247 1.419 . . . . 0.0 113.223 178.097 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -78.78 -29.57 45.1 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.272 1.429 . . . . 0.0 113.757 176.824 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 31.3 m-20 -109.74 -19.16 13.26 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -171.795 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 47.7 tp -117.37 103.26 9.96 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.218 1.807 . . . . 0.0 106.436 168.42 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 12.2 p -60.3 116.22 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 CA-C-O 121.423 0.63 . . . . 0.0 111.88 -172.393 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 6.0 t -161.97 168.64 22.5 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.215 1.406 . . . . 0.0 111.426 -179.471 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.608 ' H ' HD13 ' A' ' 109' ' ' LEU . 0.0 OUTLIER -93.0 177.59 6.02 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.635 1.574 . . . . 0.0 114.109 175.721 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -135.58 157.28 47.28 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.43 1.892 . . . . 0.0 112.293 -172.14 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 73.1 p . . . . . 0 N--CA 1.485 1.284 0 C-N-CA 127.04 2.136 . . . . 0.0 114.417 176.609 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 200' ' ' 44Z . . . . . 0.605 ' CD5' HG21 ' A' ' 92' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 . . . . . 0 CA--C 1.545 0.768 0 CA-C-O 121.992 0.901 . . . . 0.0 112.924 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.4 pp -86.09 -3.04 8.36 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 C-N-CA 127.143 2.177 . . . . 0.0 115.803 -170.42 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 57.7 t30 55.2 8.11 0.24 Allowed 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 127.813 2.445 . . . . 0.0 116.528 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.64 176.37 8.22 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.741 2.016 . . . . 0.0 111.617 178.235 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.4 m -104.19 172.08 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.175 0 C-N-CA 126.207 1.803 . . . . 0.0 112.684 -177.151 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.1 ttp-105 -87.59 138.53 31.69 Favored Pre-proline 0 N--CA 1.481 1.094 0 C-N-CA 125.175 1.39 . . . . 0.0 111.814 178.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -73.89 177.75 7.73 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 123.959 3.106 . . . . 0.0 113.71 175.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 32.1 ttmt -69.86 155.21 40.9 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.456 1.102 . . . . 0.0 111.296 179.691 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 68.4 mt -56.25 -45.71 99.88 Favored Pre-proline 0 CA--C 1.544 0.726 0 N-CA-C 116.346 1.98 . . . . 0.0 116.346 -168.174 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -64.19 -29.46 64.62 Favored 'Trans proline' 0 C--N 1.351 0.693 0 CA-C-N 122.152 1.804 . . . . 0.0 113.262 175.142 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.3 tt -71.27 -42.53 68.64 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.068 0.849 . . . . 0.0 110.14 176.009 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 11.5 tp -58.57 -37.15 75.14 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.514 -0.741 . . . . 0.0 111.408 170.093 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.7 -37.09 85.5 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.146 0.979 . . . . 0.0 113.432 175.262 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 87.8 mt -62.57 -44.53 99.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 CA-C-N 119.043 0.838 . . . . 0.0 110.973 170.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 71.2 mt -62.39 -37.54 86.15 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.529 0.732 . . . . 0.0 111.857 175.408 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -63.43 -45.28 91.66 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 121.195 -0.941 . . . . 0.0 112.368 169.535 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.62 -27.06 68.97 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.017 0.927 . . . . 0.0 113.085 177.368 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.463 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -71.49 -7.29 46.57 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.352 1.061 . . . . 0.0 113.447 173.03 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 93.18 8.6 61.33 Favored Glycine 0 CA--C 1.537 1.447 0 C-N-CA 125.537 1.541 . . . . 0.0 114.952 -178.608 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -97.62 173.94 6.89 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.891 1.276 . . . . 0.0 113.062 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 15.5 tp60 -129.51 149.19 51.39 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 126.511 1.924 . . . . 0.0 108.92 169.407 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.404 ' HA3' ' CZ ' ' A' ' 47' ' ' PHE . . . -158.68 148.92 18.73 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 116.421 1.328 . . . . 0.0 116.421 -174.053 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -133.41 -14.77 2.54 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.973 1.309 . . . . 0.0 113.829 174.252 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 6.0 mtm -175.41 137.18 0.37 Allowed 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 129.231 3.012 . . . . 0.0 109.367 -178.416 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.404 ' CZ ' ' HA3' ' A' ' 44' ' ' GLY . 0.0 OUTLIER -158.54 170.21 22.7 Favored 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 114.317 1.228 . . . . 0.0 114.317 174.062 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 70.5 p -90.44 171.62 9.3 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 126.295 1.838 . . . . 0.0 112.131 173.422 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.8 t -51.56 -44.08 33.19 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 123.634 0.774 . . . . 0.0 110.761 169.722 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -67.69 -42.86 81.4 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 125.155 1.382 . . . . 0.0 112.89 -179.186 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -72.52 -32.68 66.32 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 118.433 0.56 . . . . 0.0 112.469 179.09 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 43.7 t -63.87 -49.28 82.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 123.459 0.703 . . . . 0.0 109.703 169.155 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -65.22 -34.0 77.33 Favored 'General case' 0 N--CA 1.458 -0.072 0 C-N-CA 126.871 2.069 . . . . 0.0 114.301 -176.3 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -51.56 -52.9 43.38 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.543 0.737 . . . . 0.0 111.257 172.261 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -74.78 -32.83 62.15 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.896 1.443 . . . . 0.0 114.896 172.065 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.67 -41.41 75.54 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 120.674 1.579 . . . . 0.0 113.053 -178.507 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.27 -39.75 98.21 Favored Glycine 0 CA--C 1.533 1.178 0 CA-C-N 118.678 0.672 . . . . 0.0 111.817 173.093 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.5 tp60 -62.8 -45.33 93.16 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.786 1.234 . . . . 0.0 112.045 172.538 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.463 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 60.2 t80 -60.76 -49.71 76.41 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.896 0.879 . . . . 0.0 110.426 177.176 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 53.3 mt -62.21 -34.98 66.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 C-N-CA 124.019 0.928 . . . . 0.0 111.236 177.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.76 -38.61 91.58 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 119.575 1.08 . . . . 0.0 112.358 172.102 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 96.5 t -78.28 -34.76 18.88 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 C-N-CA 124.334 1.053 . . . . 0.0 112.998 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 19.0 mmtp -90.16 -14.94 32.51 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.961 1.304 . . . . 0.0 113.328 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.2 mp0 47.34 62.2 2.53 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 127.269 2.228 . . . . 0.0 113.876 -172.536 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 31.6 mt -82.66 -13.11 57.03 Favored 'General case' 0 N--CA 1.478 0.974 0 O-C-N 121.306 -0.871 . . . . 0.0 112.548 175.384 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 44.5 p90 -78.69 152.47 31.59 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.045 0.938 . . . . 0.0 111.744 176.12 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -83.41 127.2 33.49 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 121.834 -0.541 . . . . 0.0 110.619 169.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -65.8 -24.47 66.92 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.1 -1.0 . . . . 0.0 113.515 -176.654 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -85.5 -30.08 23.73 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-O 121.385 0.612 . . . . 0.0 111.337 -171.117 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -148.54 87.82 1.6 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 128.587 2.755 . . . . 0.0 110.064 178.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 29.2 mp0 -61.2 -14.24 24.03 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 -172.019 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 23.9 p80 -61.74 -30.76 70.99 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 118.278 -0.868 . . . . 0.0 112.378 170.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 21.5 tpp -83.07 128.53 34.57 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 119.781 1.173 . . . . 0.0 111.036 177.336 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 3.3 t -120.91 122.49 67.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 C-N-CA 126.106 1.762 . . . . 0.0 108.857 174.584 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -107.49 107.09 17.79 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.509 1.524 . . . . 0.0 109.796 178.134 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 84.2 m -99.8 20.04 14.91 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.253 1.021 . . . . 0.0 113.27 -177.014 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.69 122.98 31.85 Favored Glycine 0 CA--C 1.534 1.264 0 O-C-N 120.937 -1.102 . . . . 0.0 111.872 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 78.27 0.4 77.52 Favored Glycine 0 CA--C 1.54 1.65 0 C-N-CA 124.488 1.042 . . . . 0.0 115.374 -174.182 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -80.72 162.77 23.97 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 119.278 1.539 . . . . 0.0 111.657 171.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -46.47 -40.81 12.99 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.623 1.569 . . . . 0.0 111.743 170.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 97.1 mt -60.18 -43.66 95.68 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.088 0.955 . . . . 0.0 111.998 176.593 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -71.49 -34.15 63.62 Favored Glycine 0 CA--C 1.533 1.19 0 C-N-CA 124.99 1.281 . . . . 0.0 114.061 176.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -66.85 -42.64 85.4 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 120.637 2.219 . . . . 0.0 110.487 174.061 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 27.1 tp -61.51 -52.65 63.59 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 115.085 -0.961 . . . . 0.0 112.456 177.594 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -101.91 -6.8 23.06 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -169.568 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.86 -29.22 2.41 Favored Glycine 0 CA--C 1.54 1.651 0 O-C-N 120.349 -1.469 . . . . 0.0 112.805 -169.356 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.84 135.86 7.65 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 127.633 2.373 . . . . 0.0 111.926 179.012 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 11.6 mt-30 -142.38 45.84 1.62 Allowed 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.29 1.036 . . . . 0.0 109.831 168.749 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 1.6 m -86.33 128.41 34.92 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 121.161 -0.962 . . . . 0.0 109.184 169.532 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 17.8 p90 -158.02 168.63 26.59 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.496 0.718 . . . . 0.0 112.856 -169.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 34.6 t -118.61 138.04 52.85 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.828 170.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -77.53 -1.43 3.86 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 12.6 pttp -84.29 -7.81 59.22 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.565 1.146 . . . . 0.0 113.702 169.566 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -122.89 83.25 49.92 Favored Pre-proline 0 CA--C 1.55 0.981 0 C-N-CA 126.487 1.915 . . . . 0.0 110.819 -170.639 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -67.46 -27.88 39.28 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.88 3.054 . . . . 0.0 115.269 -170.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 59.6 m -61.79 -53.71 57.97 Favored Pre-proline 0 N--CA 1.477 0.902 0 CA-C-N 119.867 1.212 . . . . 0.0 114.192 -177.213 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -67.21 -29.98 38.35 Favored 'Trans proline' 0 C--N 1.353 0.777 0 C-N-CA 121.93 1.753 . . . . 0.0 112.636 175.225 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 27.9 tp -65.35 -44.14 88.64 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.408 1.083 . . . . 0.0 111.551 177.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 25.7 t80 -60.43 -36.39 78.07 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.865 1.266 . . . . 0.0 112.195 174.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -65.47 -47.17 77.03 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.664 0.785 . . . . 0.0 112.712 175.267 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 31.1 mtm -57.59 -49.66 75.68 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.024 0.53 . . . . 0.0 111.768 174.177 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 7.5 mp -63.11 -47.89 80.86 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-O 117.294 -1.336 . . . . 0.0 111.125 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 61.7 mtp180 -52.0 -29.65 21.73 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-N 121.067 1.758 . . . . 0.0 113.757 175.468 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -85.82 -20.21 29.5 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.594 1.557 . . . . 0.0 114.879 177.255 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -126.69 -25.64 3.36 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 115.29 1.589 . . . . 0.0 115.29 -174.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 44.7 tp -118.63 95.71 4.97 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 127.619 2.368 . . . . 0.0 107.179 170.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 12.9 p -59.57 125.54 15.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 CA-C-O 121.869 0.842 . . . . 0.0 112.718 -169.231 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 13.2 t -159.96 166.21 30.53 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 126.436 1.894 . . . . 0.0 110.248 -176.804 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.567 ' H ' HD13 ' A' ' 109' ' ' LEU . 0.0 OUTLIER -77.07 169.45 18.32 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.416 1.087 . . . . 0.0 113.521 178.89 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -115.04 160.46 19.59 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.032 1.733 . . . . 0.0 113.084 -169.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 27.3 p . . . . . 0 N--CA 1.483 1.223 0 C-N-CA 127.026 2.13 . . . . 0.0 113.995 178.475 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 200' ' ' 44Z . . . . . 0.448 ' CD3' ' CG1' ' A' ' 200' ' ' 44Z . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 . . . . . 0 CA--C 1.544 0.712 0 CA-C-O 121.015 0.435 . . . . 0.0 112.152 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 46.5 mm -78.28 129.43 37.52 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 123.874 0.869 . . . . 0.0 111.981 -175.791 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 66.8 t30 -134.88 -8.37 2.38 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 126.637 1.975 . . . . 0.0 112.565 169.265 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 17.8 pm0 -82.81 172.9 12.36 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 128.728 2.811 . . . . 0.0 112.625 177.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 34.8 m -104.14 172.31 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 126.599 1.96 . . . . 0.0 112.103 178.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.4 ptt-85 -94.29 156.98 38.25 Favored Pre-proline 0 N--CA 1.488 1.425 0 C-N-CA 124.65 1.18 . . . . 0.0 112.015 169.485 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -68.06 176.43 5.41 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 123.839 3.026 . . . . 0.0 112.756 169.627 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 24.4 ttmt -65.11 148.06 52.35 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.136 0.974 . . . . 0.0 111.2 179.268 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 81.8 mt -53.4 -50.74 81.15 Favored Pre-proline 0 N--CA 1.477 0.914 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -169.122 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -64.43 -22.07 65.96 Favored 'Trans proline' 0 CA--C 1.54 0.777 0 C-N-CA 122.262 1.975 . . . . 0.0 114.142 175.447 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.1 tt -77.9 -37.51 47.81 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 119.825 1.193 . . . . 0.0 110.54 169.719 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 16.2 tp -58.58 -35.09 71.86 Favored 'General case' 0 N--CA 1.475 0.775 0 O-C-N 120.765 -1.209 . . . . 0.0 112.264 171.405 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.439 ' HA ' ' HE2' ' A' ' 35' ' ' LYS . 9.0 mmpt? -59.84 -26.62 65.96 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 172.131 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 81.8 mt -73.04 -36.98 52.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 123.977 0.911 . . . . 0.0 110.662 176.023 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.4 mp -70.51 -34.3 72.17 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.152 -0.967 . . . . 0.0 111.279 172.492 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 43.6 m170 -63.15 -42.44 99.44 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.796 -0.565 . . . . 0.0 111.532 169.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.79 -28.54 69.94 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.153 0.981 . . . . 0.0 113.166 173.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.453 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -70.54 -6.51 36.87 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 124.153 0.981 . . . . 0.0 113.33 171.75 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 92.47 16.54 49.14 Favored Glycine 0 CA--C 1.535 1.344 0 C-N-CA 125.309 1.433 . . . . 0.0 115.142 177.394 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -123.76 139.99 53.43 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 118.77 1.285 . . . . 0.0 113.421 -176.316 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -77.04 151.86 35.36 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.164 0.986 . . . . 0.0 110.192 169.681 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -165.32 146.89 11.64 Favored Glycine 0 CA--C 1.527 0.834 0 N-CA-C 115.221 0.848 . . . . 0.0 115.221 176.553 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -137.58 -14.03 1.48 Allowed 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 114.687 1.365 . . . . 0.0 114.687 -175.645 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 5.9 mtm -176.45 126.35 0.19 Allowed 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 128.44 2.696 . . . . 0.0 109.658 -176.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -170.42 152.03 3.89 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 114.507 1.299 . . . . 0.0 114.507 176.572 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 42.9 p -75.41 175.32 8.55 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 126.351 1.861 . . . . 0.0 113.163 176.358 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 8.9 t -54.54 -50.1 61.29 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 O-C-N 120.614 -1.304 . . . . 0.0 110.401 169.246 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -56.43 -37.37 70.12 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.287 0.949 . . . . 0.0 112.587 -177.712 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -79.23 -30.79 43.38 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.687 1.195 . . . . 0.0 113.474 176.013 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 49.6 t -75.28 -46.05 39.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.124 0.97 . . . . 0.0 111.777 176.674 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.423 ' SD ' ' CD2' ' A' ' 200' ' ' 44Z . 29.4 mmt -62.36 -26.81 68.66 Favored 'General case' 0 N--CA 1.483 1.221 0 CA-C-N 119.907 1.231 . . . . 0.0 113.116 -177.71 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -51.56 -52.95 43.04 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.18 170.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -74.88 -36.99 62.25 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 170.466 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -75.18 -41.47 57.94 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 120.831 -1.168 . . . . 0.0 112.898 -171.578 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -64.11 -35.92 92.59 Favored Glycine 0 CA--C 1.531 1.052 0 O-C-N 121.654 -0.654 . . . . 0.0 111.814 171.469 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 9.1 tp60 -64.48 -44.55 90.65 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.679 1.191 . . . . 0.0 111.912 171.314 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.453 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 42.6 t80 -60.21 -48.84 80.04 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.637 0.775 . . . . 0.0 110.364 175.225 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 58.1 mt -63.04 -35.27 70.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 124.108 0.963 . . . . 0.0 111.241 177.402 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.0 tpt -65.57 -35.7 81.62 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.447 1.099 . . . . 0.0 112.516 173.17 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 64.0 t -78.35 -47.74 23.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 O-C-N 120.848 -1.158 . . . . 0.0 112.29 175.11 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 18.2 mmtp -80.62 -13.43 59.05 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.52 1.128 . . . . 0.0 112.624 -174.483 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 51.79 63.95 2.04 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 127.901 2.48 . . . . 0.0 113.434 176.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 37.1 mt -86.6 -11.27 51.93 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.726 0.81 . . . . 0.0 112.729 178.721 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 45.4 p90 -84.73 154.61 22.33 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.208 1.003 . . . . 0.0 111.632 175.245 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -88.42 129.15 35.5 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 169.285 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.75 -31.02 57.97 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 113.876 1.065 . . . . 0.0 113.876 179.23 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -93.91 -17.71 22.71 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.721 1.209 . . . . 0.0 112.702 -172.141 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -140.84 64.01 1.44 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.837 2.455 . . . . 0.0 109.677 -177.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -62.96 -18.06 62.75 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 -171.27 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 27.7 p80 -61.1 -32.03 71.71 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.624 0.77 . . . . 0.0 112.761 169.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 7.1 ttm -89.26 136.78 32.83 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.516 1.126 . . . . 0.0 112.021 178.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 3.6 t -122.19 126.58 74.52 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 C-N-CA 125.906 1.682 . . . . 0.0 108.3 172.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -106.22 101.43 10.91 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.396 1.078 . . . . 0.0 109.929 178.21 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 13.7 m -101.28 9.52 41.66 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.673 0.789 . . . . 0.0 112.976 -179.189 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.87 -27.92 65.12 Favored Glycine 0 CA--C 1.54 1.646 0 O-C-N 120.912 -1.118 . . . . 0.0 114.169 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -94.13 7.09 72.75 Favored Glycine 0 CA--C 1.541 1.674 0 C-N-CA 125.527 1.537 . . . . 0.0 115.07 171.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -105.97 167.24 9.93 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.109 1.764 . . . . 0.0 112.3 -176.638 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -46.43 -43.33 16.37 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 126.22 1.808 . . . . 0.0 111.7 169.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 81.0 mt -60.24 -39.86 88.21 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.135 0.574 . . . . 0.0 112.44 176.079 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -69.65 -37.98 77.55 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 124.573 1.082 . . . . 0.0 113.784 174.793 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -63.77 -42.73 97.75 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 120.133 1.966 . . . . 0.0 110.897 173.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 29.6 tp -62.06 -49.08 77.42 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 126.096 1.758 . . . . 0.0 112.85 179.619 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -105.28 -6.85 19.33 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.707 1.203 . . . . 0.0 113.521 -171.105 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 78.66 -30.06 2.0 Favored Glycine 0 CA--C 1.54 1.643 0 O-C-N 120.254 -1.529 . . . . 0.0 113.564 -169.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.94 132.03 9.98 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 127.942 2.497 . . . . 0.0 110.414 176.629 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -144.4 35.03 1.18 Allowed 'General case' 0 N--CA 1.476 0.843 0 CA-C-O 121.901 0.858 . . . . 0.0 110.426 176.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.2 m -99.0 139.37 34.74 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.381 0.673 . . . . 0.0 111.178 179.59 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 53.9 p90 -163.56 177.24 8.96 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.801 1.24 . . . . 0.0 112.77 -168.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 29.8 t -128.47 141.22 51.46 Favored 'General case' 0 CA--C 1.52 -0.208 0 C-N-CA 124.37 1.068 . . . . 0.0 110.921 168.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.415 HG21 ' CE5' ' A' ' 200' ' ' 44Z . 22.7 m -72.25 -9.95 13.45 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 177.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 43.8 pttt -77.11 -10.86 59.66 Favored 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 169.719 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 44.0 t0 -123.4 77.45 53.9 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 126.431 1.893 . . . . 0.0 109.615 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -70.0 -25.73 27.19 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 123.406 2.737 . . . . 0.0 114.954 -169.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 49.4 m -61.28 -53.47 62.46 Favored Pre-proline 0 N--CA 1.476 0.834 0 CA-C-N 119.867 1.212 . . . . 0.0 114.119 -177.486 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -66.05 -32.13 44.62 Favored 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.081 1.854 . . . . 0.0 113.011 176.497 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 39.1 tp -63.4 -51.49 65.57 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.63 1.172 . . . . 0.0 110.079 175.521 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 68.4 t80 -54.75 -45.92 74.26 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.437 1.095 . . . . 0.0 112.281 171.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -65.27 -35.81 82.17 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 114.077 1.139 . . . . 0.0 114.077 -175.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 55.1 mtm -68.85 -49.78 55.42 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 120.925 0.393 . . . . 0.0 111.401 169.662 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.2 mp -61.11 -29.59 69.85 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 124.805 1.242 . . . . 0.0 112.463 -179.138 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 13.7 ttm-85 -52.12 -28.4 17.68 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.701 1.6 . . . . 0.0 113.173 169.588 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -88.4 -23.41 23.34 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.496 1.518 . . . . 0.0 114.153 173.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 27.0 m120 -123.9 -22.54 4.85 Favored 'General case' 0 N--CA 1.486 1.364 0 N-CA-C 117.141 2.275 . . . . 0.0 117.141 -169.154 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 60.0 tp -129.23 154.48 46.76 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.641 1.976 . . . . 0.0 111.588 -169.305 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 11.7 p -61.37 125.94 18.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 O-C-N 121.632 -0.668 . . . . 0.0 111.048 173.453 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 3.4 t -159.7 -174.49 4.64 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.625 1.17 . . . . 0.0 111.71 -177.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -78.17 17.78 0.59 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.698 1.999 . . . . 0.0 115.292 -169.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -154.04 146.72 24.21 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.66 1.584 . . . . 0.0 111.842 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 66.8 p . . . . . 0 N--CA 1.484 1.251 0 C-N-CA 127.342 2.257 . . . . 0.0 114.759 174.348 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 200' ' ' 44Z . . . . . 0.423 ' CD2' ' SD ' ' A' ' 53' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 53.3 mm-40 . . . . . 0 CA--C 1.542 0.67 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.3 mt -136.26 151.84 29.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 125.885 1.674 . . . . 0.0 109.581 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -120.12 76.3 1.16 Allowed 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.311 1.444 . . . . 0.0 110.169 174.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 7.8 mp0 -79.5 175.08 10.93 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.584 1.154 . . . . 0.0 113.612 -172.496 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.8 m -104.13 170.43 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 126.503 1.921 . . . . 0.0 111.62 174.09 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 44.9 ttp180 -104.99 136.74 19.12 Favored Pre-proline 0 N--CA 1.479 0.976 0 C-N-CA 124.711 1.204 . . . . 0.0 110.994 177.157 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -75.99 177.93 8.1 Favored 'Trans proline' 0 CA--C 1.537 0.629 0 C-N-CA 123.171 2.581 . . . . 0.0 112.331 171.493 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.5 ttmt -63.0 148.26 48.21 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.686 0.794 . . . . 0.0 110.219 176.279 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 85.3 mt -58.17 -43.17 98.09 Favored Pre-proline 0 N--CA 1.475 0.811 0 N-CA-C 114.74 1.385 . . . . 0.0 114.74 -169.083 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -64.45 -27.24 62.48 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 CA-C-N 122.581 1.958 . . . . 0.0 114.04 174.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.9 tt -70.11 -38.84 75.7 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 120.914 -1.116 . . . . 0.0 110.014 171.079 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.9 tp -60.12 -38.63 83.6 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 121.264 -0.898 . . . . 0.0 111.808 170.069 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.423 ' HA ' ' HE2' ' A' ' 35' ' ' LYS . 8.8 mmpt? -64.05 -40.85 97.19 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.769 0.828 . . . . 0.0 112.429 173.034 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 76.0 mt -62.93 -40.31 88.44 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 124.658 1.183 . . . . 0.0 111.624 175.053 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 77.6 mt -64.0 -40.71 96.98 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 121.053 -1.03 . . . . 0.0 112.846 170.364 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 51.4 m170 -60.43 -43.99 96.23 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 119.241 0.928 . . . . 0.0 111.688 171.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -65.64 -25.57 67.42 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.504 1.121 . . . . 0.0 113.059 179.182 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.426 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -73.74 -4.42 34.4 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 123.988 0.915 . . . . 0.0 113.442 172.109 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.35 9.17 65.4 Favored Glycine 0 CA--C 1.536 1.367 0 C-N-CA 125.298 1.428 . . . . 0.0 114.8 -179.622 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -98.51 144.93 27.3 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.662 1.185 . . . . 0.0 112.277 179.668 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.6 tp60 -73.77 136.46 43.61 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 121.456 -0.778 . . . . 0.0 109.626 169.445 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -110.5 93.06 0.71 Allowed Glycine 0 CA--C 1.522 0.517 0 N-CA-C 114.317 0.487 . . . . 0.0 114.317 -172.334 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -146.85 73.64 1.32 Allowed 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.532 1.533 . . . . 0.0 109.939 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 25.7 mtm 65.35 134.31 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 129.77 3.228 . . . . 0.0 117.082 171.101 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -163.45 163.35 24.89 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 114.052 1.131 . . . . 0.0 114.052 -170.141 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 31.9 p -78.01 170.99 15.68 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.077 1.351 . . . . 0.0 112.458 172.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -53.32 -41.74 45.03 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 O-C-N 121.118 -0.989 . . . . 0.0 111.35 169.901 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -68.22 -42.95 79.02 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.517 1.127 . . . . 0.0 112.643 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -67.03 -39.28 86.98 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.332 0.653 . . . . 0.0 112.141 177.23 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 54.5 t -62.44 -46.43 96.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 123.873 0.869 . . . . 0.0 110.838 170.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.78 -37.52 86.55 Favored 'General case' 0 N--CA 1.458 -0.071 0 C-N-CA 126.243 1.817 . . . . 0.0 114.027 -175.178 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 84.4 t60 -51.62 -51.12 58.17 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 122.677 0.391 . . . . 0.0 111.498 172.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 54.5 m-85 -74.74 -33.2 62.31 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 114.522 1.304 . . . . 0.0 114.522 174.424 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.68 -42.79 77.33 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 120.703 1.592 . . . . 0.0 112.905 178.517 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.04 -44.0 98.38 Favored Glycine 0 CA--C 1.53 1.008 0 N-CA-C 111.548 -0.621 . . . . 0.0 111.548 173.272 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.7 tp60 -60.27 -42.05 94.59 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.449 1.099 . . . . 0.0 112.429 172.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.426 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 68.3 t80 -64.6 -51.66 61.57 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.837 1.255 . . . . 0.0 110.718 178.922 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 59.8 mt -62.09 -37.47 78.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 C-N-CA 123.855 0.862 . . . . 0.0 110.398 178.707 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -63.58 -47.3 82.07 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.492 1.117 . . . . 0.0 112.748 174.247 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.0 p -78.43 -28.06 14.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 124.111 0.965 . . . . 0.0 113.5 -174.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 20.9 mmtp -95.48 -12.03 26.53 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.317 1.447 . . . . 0.0 113.826 174.779 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 16.5 mp0 55.37 61.41 2.89 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.612 1.965 . . . . 0.0 113.632 -177.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 40.2 mt -92.77 4.53 53.63 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.543 0.737 . . . . 0.0 112.907 173.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 51.7 p90 -89.46 153.67 20.64 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.362 1.465 . . . . 0.0 110.531 169.706 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -79.69 122.29 26.37 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.732 -0.605 . . . . 0.0 109.381 169.556 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 4.6 pm0 -61.86 -34.83 76.7 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.732 1.012 . . . . 0.0 113.732 -174.229 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -82.86 -25.21 32.79 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.614 0.766 . . . . 0.0 111.799 -175.905 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -139.98 74.51 1.47 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.998 2.119 . . . . 0.0 110.682 -179.231 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -58.23 -14.93 8.19 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 114.697 1.369 . . . . 0.0 114.697 -178.614 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 21.7 p80 -67.8 -1.91 6.25 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 117.995 -1.002 . . . . 0.0 113.668 169.462 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 14.8 ttm -117.74 140.01 50.27 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.933 1.693 . . . . 0.0 113.284 169.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 54.8 t -115.71 142.42 28.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 127.572 2.349 . . . . 0.0 109.608 169.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -123.04 52.83 1.33 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.287 1.435 . . . . 0.0 112.135 -173.194 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 67.9 m -75.16 2.41 10.9 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 120.748 -1.22 . . . . 0.0 114.277 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.36 -23.64 54.06 Favored Glycine 0 CA--C 1.539 1.586 0 CA-C-N 120.155 1.343 . . . . 0.0 114.655 173.719 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -88.34 2.46 85.05 Favored Glycine 0 CA--C 1.54 1.651 0 C-N-CA 124.964 1.269 . . . . 0.0 115.34 171.765 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -111.56 -174.42 2.46 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 119.158 1.479 . . . . 0.0 113.217 -172.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -63.92 -33.9 76.74 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 120.873 -1.142 . . . . 0.0 111.759 176.402 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.5 tp -65.22 -38.61 90.96 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-O 121.821 0.819 . . . . 0.0 110.207 173.669 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -64.02 -40.63 98.37 Favored Glycine 0 CA--C 1.532 1.138 0 C-N-CA 125.074 1.321 . . . . 0.0 113.602 171.468 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -73.07 -29.42 62.95 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 120.248 2.024 . . . . 0.0 112.009 177.559 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 23.7 tp -65.57 -50.01 66.73 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.023 1.329 . . . . 0.0 111.65 172.446 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.45 -5.78 31.74 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 -173.604 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 77.74 -28.19 1.86 Allowed Glycine 0 CA--C 1.54 1.652 0 C-N-CA 125.502 1.525 . . . . 0.0 113.627 -170.475 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.3 128.83 9.22 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 127.925 2.49 . . . . 0.0 110.451 175.499 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -140.63 40.57 1.86 Allowed 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.608 1.163 . . . . 0.0 110.072 175.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 10.7 m -103.77 132.22 50.23 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 169.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 40.1 p90 -163.51 169.32 18.94 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.219 1.407 . . . . 0.0 112.384 -167.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 17.2 m -107.64 135.3 49.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 122.396 1.093 . . . . 0.0 110.95 173.114 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -78.16 -23.4 13.66 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 C-N-CA 125.839 1.656 . . . . 0.0 113.332 -169.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.7 pttt -79.97 -5.28 55.39 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 126.299 1.84 . . . . 0.0 115.333 179.12 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 42.8 t0 -116.21 86.32 17.17 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 126.373 1.869 . . . . 0.0 110.735 -170.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -61.1 -36.94 79.12 Favored 'Trans proline' 0 CA--C 1.537 0.674 0 C-N-CA 124.29 3.327 . . . . 0.0 115.423 -170.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 67.9 m -58.95 -54.91 51.72 Favored Pre-proline 0 N--CA 1.477 0.894 0 CA-C-N 119.848 1.204 . . . . 0.0 114.076 -175.441 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -70.05 -24.75 27.98 Favored 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 121.956 1.771 . . . . 0.0 112.97 175.415 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 24.0 tp -67.83 -48.94 64.81 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.323 1.049 . . . . 0.0 110.822 178.586 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 22.9 m-30 -62.5 -35.71 80.25 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.856 0.862 . . . . 0.0 112.572 177.91 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -59.88 -42.32 93.52 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.002 0.921 . . . . 0.0 112.735 178.376 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.424 ' HB2' ' HE2' ' A' ' 101' ' ' MET . 35.4 mtm -72.01 -48.67 43.01 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.795 0.838 . . . . 0.0 112.521 172.727 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -59.13 -39.59 82.83 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-O 117.793 -1.099 . . . . 0.0 110.974 -175.596 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 76.6 mtt180 -54.71 -25.48 27.73 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 171.527 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -87.67 -24.1 24.01 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.437 1.495 . . . . 0.0 114.081 173.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -111.05 -28.38 8.34 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 114.112 1.152 . . . . 0.0 114.112 -170.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 3.2 tt -133.93 117.55 16.87 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 127.587 2.355 . . . . 0.0 108.021 -177.123 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 84.2 t -61.49 119.36 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 O-C-N 121.588 -0.695 . . . . 0.0 111.332 -171.313 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 5.2 t -158.35 179.73 8.87 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 126.551 1.94 . . . . 0.0 110.346 178.019 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -94.14 170.43 9.53 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.535 1.134 . . . . 0.0 113.723 -170.857 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -125.2 169.87 11.81 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.741 2.017 . . . . 0.0 113.175 -169.638 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 12.0 t . . . . . 0 N--CA 1.479 1.021 0 C-N-CA 124.155 0.982 . . . . 0.0 113.458 176.673 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 200' ' ' 44Z . . . . . 0.438 ' CD3' ' CG1' ' A' ' 200' ' ' 44Z . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 . . . . . 0 CA--C 1.543 0.691 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.3 mt -117.46 30.74 2.13 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.975 0 C-N-CA 126.688 1.995 . . . . 0.0 109.822 179.573 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 69.4 m-20 50.74 34.71 10.48 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 126.636 1.974 . . . . 0.0 113.673 -175.081 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.1 pm0 -84.56 173.55 10.71 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -171.07 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 35.7 m -131.37 172.36 16.39 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 127.054 2.141 . . . . 0.0 111.548 -176.542 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.8 ttp-105 -93.73 137.15 23.31 Favored Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 125.405 1.482 . . . . 0.0 111.438 178.113 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -75.81 177.98 8.01 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 124.36 3.374 . . . . 0.0 113.843 -178.129 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.9 ttmt -61.82 147.08 47.62 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.366 1.066 . . . . 0.0 110.549 175.708 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.3 mp -54.07 -48.09 95.16 Favored Pre-proline 0 N--CA 1.472 0.67 0 N-CA-C 115.016 1.487 . . . . 0.0 115.016 -168.382 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -60.56 -31.26 92.1 Favored 'Trans proline' 0 CA--C 1.537 0.642 0 CA-C-N 122.053 1.769 . . . . 0.0 113.796 177.131 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 7.5 tt -77.59 -34.7 53.49 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 120.941 -1.1 . . . . 0.0 111.381 177.42 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 45.1 tp -61.36 -38.53 87.28 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.697 -0.627 . . . . 0.0 111.005 169.304 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -66.57 -35.58 80.56 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.83 0.852 . . . . 0.0 113.042 174.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 93.5 mt -60.55 -45.48 97.08 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 CA-C-N 119.41 1.004 . . . . 0.0 111.061 169.607 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.1 mp -69.22 -30.79 69.03 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 121.047 -1.033 . . . . 0.0 112.864 177.635 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 30.1 m170 -67.39 -42.88 82.62 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.188 -0.945 . . . . 0.0 111.557 169.693 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.23 -25.33 68.02 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.18 0.992 . . . . 0.0 113.117 174.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.411 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -69.62 -9.17 53.06 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 171.282 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 78.65 19.99 72.27 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 125.144 1.354 . . . . 0.0 114.254 -177.484 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -108.23 7.62 27.47 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 116.048 1.87 . . . . 0.0 116.048 -169.681 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.427 ' HG2' ' H ' ' A' ' 44' ' ' GLY . 7.3 tt0 48.85 -159.43 0.05 Allowed 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 126.069 1.748 . . . . 0.0 111.211 -169.218 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.427 ' H ' ' HG2' ' A' ' 43' ' ' GLN . . . 165.36 134.66 1.7 Allowed Glycine 0 N--CA 1.469 0.84 0 O-C-N 120.49 -1.381 . . . . 0.0 115.369 169.827 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -138.67 -19.99 1.03 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.794 1.238 . . . . 0.0 114.143 174.657 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 3.8 mtm -174.5 131.41 0.36 Allowed 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 128.0 2.52 . . . . 0.0 109.899 -178.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -163.56 152.4 14.08 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 114.569 1.322 . . . . 0.0 114.569 173.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 67.4 p -82.26 174.68 10.94 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 128.153 2.581 . . . . 0.0 112.343 174.39 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -53.06 -50.37 45.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 CA-C-N 119.908 1.231 . . . . 0.0 109.9 169.046 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 59.1 tptt -55.43 -37.87 68.23 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 119.043 0.838 . . . . 0.0 112.675 -176.556 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -80.4 -38.85 29.48 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.524 1.13 . . . . 0.0 113.265 175.69 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 41.9 t -68.11 -50.41 58.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 O-C-N 121.303 -0.873 . . . . 0.0 111.357 -179.195 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.7 mmm -68.66 -23.91 64.47 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 119.344 0.975 . . . . 0.0 112.642 -173.609 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -58.9 -55.6 33.07 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.657 0.783 . . . . 0.0 111.303 169.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -74.46 -32.08 62.47 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 177.465 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.83 -38.57 76.59 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 120.881 -1.137 . . . . 0.0 111.12 174.911 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.85 -42.05 99.75 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 124.194 0.902 . . . . 0.0 112.41 171.422 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.8 tp60 -60.37 -43.63 96.37 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.226 1.011 . . . . 0.0 112.11 171.397 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.411 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 61.6 t80 -60.44 -52.49 64.99 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.838 0.855 . . . . 0.0 110.788 174.727 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 44.0 mt -60.17 -37.04 71.75 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 124.084 0.954 . . . . 0.0 111.071 179.167 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -64.33 -46.6 82.79 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.372 1.069 . . . . 0.0 112.401 174.17 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.5 p -78.51 -28.52 14.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 N-CA-C 113.66 0.985 . . . . 0.0 113.66 -176.032 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 57.3 mmtt -91.88 -15.83 27.56 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.148 1.379 . . . . 0.0 113.731 175.038 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 14.1 mp0 54.23 73.26 0.4 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.973 2.109 . . . . 0.0 113.227 -172.209 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.3 tp -94.62 18.56 11.27 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.892 1.277 . . . . 0.0 112.484 178.542 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 51.2 p90 -127.53 160.3 31.94 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.628 1.971 . . . . 0.0 111.348 -173.796 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -81.34 124.74 29.62 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 121.567 -0.708 . . . . 0.0 111.176 172.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.02 -20.19 56.55 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 174.074 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -80.7 -36.69 31.9 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.732 0.813 . . . . 0.0 111.433 -176.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -149.55 92.38 1.92 Allowed 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 127.439 2.296 . . . . 0.0 109.441 -176.099 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 27.5 mp0 -65.59 -12.41 52.88 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 -169.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 24.3 p80 -66.01 -23.26 66.53 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 170.443 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 1.9 tpt -81.69 118.84 23.15 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.818 1.647 . . . . 0.0 110.498 175.871 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 18.2 t -104.14 130.64 54.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 125.904 1.682 . . . . 0.0 108.286 171.158 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 79.5 t80 -132.45 112.6 12.28 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.227 1.011 . . . . 0.0 109.686 -177.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 23.0 p -76.67 -28.98 56.17 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 114.539 1.311 . . . . 0.0 114.539 -169.426 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 50.87 -123.84 18.28 Favored Glycine 0 CA--C 1.539 1.567 0 CA-C-N 119.161 0.891 . . . . 0.0 112.136 -173.225 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -87.77 12.46 63.56 Favored Glycine 0 CA--C 1.542 1.733 0 C-N-CA 125.433 1.492 . . . . 0.0 116.214 176.745 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -63.12 159.38 17.55 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 119.746 1.773 . . . . 0.0 113.31 -179.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.1 mp -49.17 -37.37 22.18 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.799 1.64 . . . . 0.0 113.465 171.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 89.5 mt -59.76 -44.83 93.67 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 118.911 0.778 . . . . 0.0 111.405 175.511 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -73.14 -36.73 56.1 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 124.248 0.928 . . . . 0.0 113.099 176.079 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.29 -28.36 66.21 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 119.782 1.791 . . . . 0.0 112.191 178.762 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 42.9 tp -80.07 -54.53 5.69 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 124.289 1.036 . . . . 0.0 112.71 172.601 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -88.98 -7.03 56.77 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 123.846 0.858 . . . . 0.0 113.267 -172.095 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.41 -28.61 3.01 Favored Glycine 0 CA--C 1.54 1.605 0 C-N-CA 125.568 1.556 . . . . 0.0 113.001 -169.495 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.92 139.06 6.09 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 127.67 2.388 . . . . 0.0 111.6 -179.335 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -147.19 54.91 1.09 Allowed 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.904 1.282 . . . . 0.0 109.96 168.8 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 6.8 m -104.79 130.74 52.83 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-O 121.168 0.509 . . . . 0.0 109.793 169.46 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 54.4 p90 -168.22 177.04 5.65 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.786 1.634 . . . . 0.0 111.458 -168.299 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 67.2 p -121.55 143.24 49.4 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 174.205 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.484 HG21 ' CE5' ' A' ' 200' ' ' 44Z . 20.5 m -71.28 -15.18 18.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 N-CA-C 113.996 1.11 . . . . 0.0 113.996 -173.19 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.0 pttt -77.59 -8.12 57.37 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 126.335 1.854 . . . . 0.0 114.419 172.076 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 44.6 t0 -119.6 78.17 21.0 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 126.142 1.777 . . . . 0.0 110.516 -177.199 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -68.56 -27.61 32.68 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 123.756 2.971 . . . . 0.0 115.288 -169.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 63.7 m -59.35 -54.39 56.62 Favored Pre-proline 0 N--CA 1.478 0.933 0 CA-C-N 120.341 1.428 . . . . 0.0 113.753 -177.504 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -66.46 -28.9 45.61 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 121.797 1.664 . . . . 0.0 112.585 173.799 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.97 -52.88 63.84 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.793 1.237 . . . . 0.0 110.631 176.006 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -66.48 -29.28 69.36 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.94 0.896 . . . . 0.0 113.379 174.813 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -61.76 -50.38 72.61 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.699 1.591 . . . . 0.0 112.377 174.48 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 36.4 mtm -65.53 -43.08 91.1 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.026 0.53 . . . . 0.0 111.595 175.147 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 42.8 mt -66.04 -42.27 89.8 Favored 'General case' 0 C--O 1.218 -0.578 0 CA-C-O 117.174 -1.393 . . . . 0.0 112.052 -179.224 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -56.02 -29.03 59.78 Favored 'General case' 0 N--CA 1.484 1.255 0 CA-C-N 121.347 1.885 . . . . 0.0 113.613 173.257 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -82.71 -17.6 43.85 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.518 1.527 . . . . 0.0 113.424 175.321 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -120.87 -15.0 8.41 Favored 'General case' 0 CA--C 1.556 1.196 0 N-CA-C 115.292 1.59 . . . . 0.0 115.292 -172.723 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 29.6 tp -150.38 139.93 21.55 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 130.484 3.514 . . . . 0.0 108.598 -171.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 48.7 t -75.47 109.99 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 O-C-N 120.795 -1.191 . . . . 0.0 109.387 174.443 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 7.7 t -155.27 170.16 22.52 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.18 1.392 . . . . 0.0 111.841 -177.783 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.644 ' H ' HD13 ' A' ' 109' ' ' LEU . 0.0 OUTLIER -79.46 177.3 8.96 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.288 1.435 . . . . 0.0 114.124 -178.665 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -126.86 -176.95 3.85 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.696 1.598 . . . . 0.0 113.818 -169.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 6.0 t . . . . . 0 N--CA 1.475 0.815 0 C-N-CA 125.946 1.698 . . . . 0.0 112.747 -170.554 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 200' ' ' 44Z . . . . . 0.484 ' CE5' HG21 ' A' ' 92' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 . . . . . 0 CA--C 1.539 0.547 0 CA-C-O 121.896 0.855 . . . . 0.0 112.25 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.415 HG12 ' H ' ' A' ' 24' ' ' ILE . 23.2 pt -87.45 -16.25 9.22 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.11 0 N-CA-C 116.989 2.218 . . . . 0.0 116.989 -169.41 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 54.6 t30 53.18 34.49 17.62 Favored 'General case' 0 CA--C 1.557 1.214 0 C-N-CA 126.185 1.794 . . . . 0.0 113.858 -174.316 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 27.9 mm100 -94.77 167.03 11.69 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.507 1.923 . . . . 0.0 112.218 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 35.5 m -104.17 159.89 4.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 125.323 1.449 . . . . 0.0 113.257 -169.469 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 84.1 mtm-85 -91.75 138.63 24.92 Favored Pre-proline 0 N--CA 1.479 0.992 0 C-N-CA 124.432 1.093 . . . . 0.0 111.167 176.33 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -80.92 171.88 13.73 Favored 'Trans proline' 0 CA--C 1.538 0.679 0 C-N-CA 123.986 3.124 . . . . 0.0 113.038 178.361 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.03 149.43 15.51 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.664 0.786 . . . . 0.0 112.475 173.674 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 92.5 mt -59.85 -50.03 88.6 Favored Pre-proline 0 N--CA 1.476 0.875 0 N-CA-C 114.099 1.148 . . . . 0.0 114.099 -175.015 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -67.33 -21.34 47.65 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 121.897 1.731 . . . . 0.0 113.118 174.515 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.4 tt -69.66 -46.03 67.04 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 118.944 0.793 . . . . 0.0 109.826 170.226 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.2 tp -60.31 -31.76 70.58 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 120.865 -1.147 . . . . 0.0 112.955 176.467 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.62 -28.85 68.84 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 121.493 -0.754 . . . . 0.0 112.678 171.559 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 45.0 mt -71.03 -43.89 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 CA-C-N 119.073 0.851 . . . . 0.0 110.573 173.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.88 -38.94 87.4 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.485 0.714 . . . . 0.0 110.733 175.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 53.3 m170 -66.46 -43.83 84.44 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.426 0.69 . . . . 0.0 112.457 172.301 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.43 -27.99 69.67 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.945 0.898 . . . . 0.0 113.376 176.606 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.426 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -72.74 -5.22 36.29 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 124.222 1.009 . . . . 0.0 113.475 172.834 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.54 9.04 65.18 Favored Glycine 0 CA--C 1.537 1.456 0 C-N-CA 125.422 1.487 . . . . 0.0 115.102 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -97.96 165.67 11.81 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.752 1.221 . . . . 0.0 112.952 179.341 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 21.7 tm0? -118.03 145.22 44.94 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.65 1.58 . . . . 0.0 109.335 169.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -171.77 158.46 29.34 Favored Glycine 0 N--CA 1.467 0.724 0 N-CA-C 116.287 1.275 . . . . 0.0 116.287 -169.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -140.44 -63.69 0.48 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.987 1.715 . . . . 0.0 109.643 169.495 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 3.3 mpp? -101.63 141.7 34.1 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 127.14 2.176 . . . . 0.0 112.183 179.304 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 25.0 m-85 -154.41 159.78 41.28 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.369 1.067 . . . . 0.0 113.678 -175.261 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 71.3 p -95.21 175.02 6.77 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.353 1.461 . . . . 0.0 108.052 166.111 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -59.08 -40.18 80.24 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 O-C-N 120.011 -1.681 . . . . 0.0 109.981 169.148 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -59.8 -43.99 94.18 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.768 1.227 . . . . 0.0 112.756 178.33 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -72.67 -36.74 67.99 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 178.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 75.3 t -65.73 -51.95 56.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 CA-C-N 119.388 0.995 . . . . 0.0 110.669 171.36 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.4 ppp? -68.88 -26.06 64.93 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -169.191 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 82.8 t60 -60.18 -53.49 57.09 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 119.101 0.864 . . . . 0.0 111.27 172.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 57.3 m-85 -74.4 -30.38 61.92 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 178.737 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -68.64 -39.76 80.57 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.326 0.966 . . . . 0.0 112.735 172.803 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.52 -43.58 97.9 Favored Glycine 0 CA--C 1.532 1.132 0 CA-C-N 118.761 0.71 . . . . 0.0 111.722 172.639 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 36.1 tp60 -58.67 -45.35 89.61 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.104 0.961 . . . . 0.0 112.156 170.499 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.426 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 51.7 t80 -60.62 -51.59 68.75 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.708 0.803 . . . . 0.0 110.433 177.784 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 48.7 mt -59.19 -38.87 76.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 124.368 1.067 . . . . 0.0 111.039 178.188 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.0 tpt -64.57 -45.3 87.62 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.387 1.075 . . . . 0.0 112.726 175.05 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.1 p -78.67 -29.54 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-N 119.703 1.138 . . . . 0.0 113.716 -177.024 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 58.0 mmtt -90.74 -15.91 29.38 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.806 1.242 . . . . 0.0 113.36 175.356 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 14.1 mp0 50.89 73.73 0.27 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 127.182 2.193 . . . . 0.0 112.856 -172.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 11.8 tp -87.44 -4.45 59.01 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.855 0.862 . . . . 0.0 112.187 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 51.3 p90 -99.18 160.0 14.58 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.53 1.932 . . . . 0.0 111.784 177.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -91.99 134.28 34.95 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 169.29 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -59.6 -32.21 70.18 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -174.471 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -86.62 -20.49 27.78 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 123.795 0.838 . . . . 0.0 112.578 -169.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -140.37 63.28 1.47 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 127.985 2.514 . . . . 0.0 110.257 -178.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -60.22 -19.77 55.89 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.966 0.906 . . . . 0.0 113.254 -179.238 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 31.8 p80 -63.09 -7.32 5.35 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.43 1.092 . . . . 0.0 113.889 170.488 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 39.4 mtp -121.0 149.25 42.95 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.35 1.46 . . . . 0.0 112.926 169.287 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.9 p -124.1 144.37 34.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 126.075 1.75 . . . . 0.0 109.62 173.348 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -128.73 110.13 11.92 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.792 1.237 . . . . 0.0 110.586 -170.559 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 19.8 p -78.61 17.09 0.73 Allowed 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 116.723 2.12 . . . . 0.0 116.723 -168.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -53.57 113.14 2.83 Favored Glycine 0 CA--C 1.537 1.438 0 CA-C-N 119.577 1.08 . . . . 0.0 113.605 -172.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 73.6 9.34 78.28 Favored Glycine 0 CA--C 1.541 1.665 0 C-N-CA 124.979 1.276 . . . . 0.0 115.791 -177.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -86.88 158.67 19.28 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 119.355 1.577 . . . . 0.0 113.531 -175.729 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 27.9 mt -54.31 -37.22 64.59 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.926 1.29 . . . . 0.0 113.126 169.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.61 -42.34 96.63 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.373 -0.829 . . . . 0.0 111.347 174.334 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -70.49 -34.01 67.89 Favored Glycine 0 CA--C 1.532 1.109 0 CA-C-O 118.609 -1.106 . . . . 0.0 112.986 175.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -71.62 -29.24 64.45 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 120.218 2.009 . . . . 0.0 111.79 175.205 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 27.7 tp -71.32 -53.09 15.4 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 124.777 1.231 . . . . 0.0 112.419 174.218 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -102.49 -9.74 19.97 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.085 1.143 . . . . 0.0 114.085 -169.667 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.03 -32.89 1.97 Allowed Glycine 0 CA--C 1.54 1.625 0 C-N-CA 124.896 1.236 . . . . 0.0 112.57 -169.074 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.45 123.19 8.62 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 126.777 2.031 . . . . 0.0 112.553 174.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 -136.86 33.8 2.65 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.595 1.558 . . . . 0.0 111.172 177.837 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 11.4 m -94.14 132.37 38.74 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 169.702 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 49.6 p90 -162.35 172.33 15.8 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.335 1.054 . . . . 0.0 112.961 -169.449 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 81.6 p -116.19 136.42 53.03 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 122.452 1.12 . . . . 0.0 113.586 175.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -78.05 -17.69 13.86 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.442 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 -174.668 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.5 pttt -72.8 -8.47 55.63 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.666 1.586 . . . . 0.0 114.637 175.42 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -120.57 83.36 34.58 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 126.386 1.875 . . . . 0.0 110.147 -177.178 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -68.12 -25.2 37.74 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.862 3.041 . . . . 0.0 115.224 -169.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 62.5 m -63.52 -54.89 39.55 Favored Pre-proline 0 N--CA 1.476 0.875 0 CA-C-N 119.813 1.188 . . . . 0.0 113.87 -178.445 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -65.5 -30.38 52.37 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 121.827 1.685 . . . . 0.0 112.553 175.396 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 22.4 tp -62.61 -47.95 81.54 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.983 0.913 . . . . 0.0 111.11 174.789 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -59.99 -37.98 81.27 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 121.489 -0.757 . . . . 0.0 112.179 173.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -64.28 -47.26 80.22 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.043 0.937 . . . . 0.0 112.939 176.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.453 ' HB2' ' HE2' ' A' ' 101' ' ' MET . 3.9 mtp -56.9 -44.46 82.38 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.335 1.054 . . . . 0.0 112.111 172.293 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.1 mp -62.53 -47.17 85.06 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.392 1.077 . . . . 0.0 110.567 176.372 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 14.8 mtt180 -56.98 -21.64 31.96 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.68 1.192 . . . . 0.0 114.142 171.011 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -98.57 -5.17 32.54 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 126.396 1.878 . . . . 0.0 115.01 175.342 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 18.9 p30 -115.88 -27.6 6.95 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 120.349 1.432 . . . . 0.0 114.479 175.347 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 39.8 tp -91.27 99.32 12.32 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 126.565 1.946 . . . . 0.0 111.905 175.801 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . 0.324 0.4 OUTLIER 58.47 1.94 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 N-CA-C 120.127 3.38 . . . . 0.0 120.127 169.726 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 3.0 t -165.5 -179.83 5.69 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 124.416 1.086 . . . . 0.0 112.921 -177.431 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -118.43 71.45 0.84 Allowed 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 127.185 2.194 . . . . 0.0 111.245 173.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . 56.23 -174.49 0.06 Allowed 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 126.339 1.856 . . . . 0.0 115.088 -178.188 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 11.8 t . . . . . 0 N--CA 1.48 1.045 0 C-N-CA 124.216 1.006 . . . . 0.0 113.293 -179.738 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 200' ' ' 44Z . . . . . 0.476 ' CD3' ' CD1' ' A' ' 200' ' ' 44Z . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 26.2 mp0 . . . . . 0 CA--C 1.542 0.668 0 CA-C-O 121.174 0.512 . . . . 0.0 112.322 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 15.0 mt -132.1 150.78 34.01 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 125.884 1.674 . . . . 0.0 109.479 -178.652 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 48.4 p-10 -100.22 32.83 2.84 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 126.304 1.841 . . . . 0.0 113.617 178.027 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 5.1 pm0 -80.18 169.51 17.7 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.16 1.384 . . . . 0.0 113.453 -176.245 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 33.5 m -127.77 172.24 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 126.124 1.77 . . . . 0.0 111.706 -177.608 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.7 ttp-105 -87.11 133.04 39.83 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 124.693 1.197 . . . . 0.0 111.721 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -73.19 175.8 10.04 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 123.586 2.857 . . . . 0.0 112.228 173.415 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.5 tpmt? -61.52 147.31 45.82 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.472 0.709 . . . . 0.0 110.605 177.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -59.32 -40.63 82.05 Favored Pre-proline 0 N--CA 1.473 0.714 0 CA-C-O 117.32 -1.324 . . . . 0.0 114.239 -170.265 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -61.06 -33.85 91.06 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 121.994 1.796 . . . . 0.0 113.696 173.226 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.2 tt -70.12 -40.75 74.7 Favored 'General case' 0 CA--C 1.546 0.804 0 O-C-N 121.469 -0.769 . . . . 0.0 109.666 175.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.8 tt -63.91 -35.4 80.54 Favored 'General case' 0 N--CA 1.475 0.825 0 O-C-N 120.858 -1.151 . . . . 0.0 112.791 172.367 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.66 -38.91 92.15 Favored 'General case' 0 N--CA 1.48 1.026 0 O-C-N 121.216 -0.928 . . . . 0.0 112.223 170.684 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 91.8 mt -67.06 -38.33 81.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 123.676 0.79 . . . . 0.0 111.636 174.065 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 77.0 mt -61.99 -40.73 96.63 Favored 'General case' 0 CA--C 1.544 0.75 0 O-C-N 121.107 -0.996 . . . . 0.0 112.142 170.804 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 34.8 m170 -62.22 -42.95 99.77 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 119.332 0.969 . . . . 0.0 112.293 170.03 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.25 -25.43 68.05 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 177.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.56 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -72.91 -7.37 50.66 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 172.888 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 89.4 6.35 71.02 Favored Glycine 0 CA--C 1.537 1.449 0 C-N-CA 125.228 1.394 . . . . 0.0 114.584 -175.652 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -87.71 177.86 6.91 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.706 1.202 . . . . 0.0 112.263 175.279 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.96 149.3 43.12 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.257 1.423 . . . . 0.0 109.942 172.339 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 176.12 161.68 25.68 Favored Glycine 0 CA--C 1.527 0.802 0 N-CA-C 116.791 1.476 . . . . 0.0 116.791 170.475 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -125.65 8.52 7.62 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 126.018 1.727 . . . . 0.0 112.444 171.265 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.1 mtm -170.95 135.36 1.03 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 128.888 2.875 . . . . 0.0 109.055 -177.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -149.27 144.39 26.47 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -176.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 46.6 p -86.59 169.47 12.73 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.471 1.108 . . . . 0.0 111.304 168.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.1 t -56.16 -46.18 81.06 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 O-C-N 120.661 -1.274 . . . . 0.0 109.943 169.338 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -56.59 -35.93 68.8 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.721 0.808 . . . . 0.0 113.074 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -77.32 -46.16 23.82 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 173.195 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 74.8 t -63.93 -49.45 81.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 O-C-N 121.451 -0.781 . . . . 0.0 111.756 -177.219 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -71.24 -27.28 63.36 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 119.89 1.223 . . . . 0.0 112.287 -172.261 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -58.81 -54.45 46.95 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.345 0.658 . . . . 0.0 111.118 170.528 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -74.35 -32.29 62.73 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 178.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -68.05 -41.98 81.19 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 119.996 1.271 . . . . 0.0 111.823 173.591 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -61.36 -47.28 91.67 Favored Glycine 0 CA--C 1.527 0.81 0 CA-C-N 119.018 0.826 . . . . 0.0 111.624 173.623 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.3 tp60 -55.97 -47.9 76.8 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.384 1.073 . . . . 0.0 112.094 172.617 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.56 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 47.9 t80 -60.36 -48.79 80.25 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.121 0.968 . . . . 0.0 110.894 177.609 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 58.3 mt -60.85 -36.93 74.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 125.21 1.404 . . . . 0.0 111.148 178.244 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 35.3 mmt -66.34 -38.52 87.83 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.551 1.068 . . . . 0.0 113.051 171.304 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 82.2 t -78.31 -32.21 16.66 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 CA-C-N 119.217 0.917 . . . . 0.0 112.906 -178.181 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 47.2 mmtt -91.47 -15.54 28.67 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.159 1.383 . . . . 0.0 113.0 177.138 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.5 mp0 52.3 63.98 2.03 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.344 1.857 . . . . 0.0 113.038 -173.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 89.5 mt -92.46 18.95 7.74 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 124.432 1.093 . . . . 0.0 112.146 176.016 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 36.0 p90 -124.33 158.49 32.49 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 126.517 1.927 . . . . 0.0 111.005 -177.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -87.08 128.43 35.1 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.791 -0.568 . . . . 0.0 111.175 172.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -61.51 -20.72 63.52 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 172.059 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -81.78 -36.56 28.32 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.055 0.942 . . . . 0.0 111.291 -177.498 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -148.24 85.02 1.51 Allowed 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 127.321 2.248 . . . . 0.0 109.867 -173.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 28.3 mp0 -62.5 -15.64 51.28 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -172.321 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 27.3 p80 -65.88 -23.74 66.71 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 172.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.2 tpt -81.77 128.66 34.23 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.536 1.534 . . . . 0.0 110.758 175.186 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 3.9 t -126.16 112.39 29.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 C-N-CA 125.48 1.512 . . . . 0.0 109.4 179.306 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 35.9 t80 -95.46 52.25 1.37 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.875 1.27 . . . . 0.0 112.09 -170.181 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 55.6 m -69.69 -5.39 24.65 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 179.426 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.63 -25.12 58.04 Favored Glycine 0 CA--C 1.541 1.704 0 CA-C-N 120.116 1.326 . . . . 0.0 113.524 169.416 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -88.81 2.83 84.66 Favored Glycine 0 CA--C 1.542 1.728 0 C-N-CA 125.392 1.472 . . . . 0.0 115.295 171.54 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -108.93 172.99 6.52 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.174 1.79 . . . . 0.0 112.552 -177.516 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.8 tp -46.57 -43.05 16.84 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 126.809 2.044 . . . . 0.0 112.11 169.31 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 67.4 mt -54.79 -43.14 72.6 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-O 122.113 0.959 . . . . 0.0 112.159 173.434 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -74.64 -32.24 57.63 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 125.95 1.738 . . . . 0.0 114.412 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -67.25 -42.66 83.57 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 120.109 1.955 . . . . 0.0 110.374 169.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 24.9 tp -59.64 -50.95 71.88 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.413 1.485 . . . . 0.0 111.903 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -96.58 -13.8 22.67 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 -178.591 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.77 -18.24 12.85 Favored Glycine 0 CA--C 1.541 1.688 0 C-N-CA 125.641 1.591 . . . . 0.0 115.825 -178.772 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.41 17.99 1.52 Allowed 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 115.934 1.827 . . . . 0.0 115.934 -176.697 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.7 tp60 -68.05 40.73 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.045 0 N-CA-C 118.011 2.597 . . . . 0.0 118.011 -167.303 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 72.4 m -97.71 144.01 27.78 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 120.419 -1.426 . . . . 0.0 109.202 168.556 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 55.0 p90 -159.5 162.98 35.62 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -169.016 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 13.8 m -125.43 136.55 53.51 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.394 1.078 . . . . 0.0 110.679 177.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.488 HG21 ' CE5' ' A' ' 200' ' ' 44Z . 20.1 m -77.42 -11.38 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -170.513 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -78.04 -13.88 59.71 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.875 1.27 . . . . 0.0 113.498 178.017 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -120.56 81.22 31.64 Favored Pre-proline 0 CA--C 1.547 0.86 0 C-N-CA 127.916 2.486 . . . . 0.0 108.874 179.842 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.18 -27.51 16.67 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 123.502 2.801 . . . . 0.0 114.739 -169.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 45.6 m -57.28 -51.06 84.54 Favored Pre-proline 0 N--CA 1.478 0.938 0 CA-C-N 120.342 1.428 . . . . 0.0 114.21 -178.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -67.49 -27.45 39.5 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 121.901 1.734 . . . . 0.0 113.38 175.088 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 21.8 tp -68.81 -42.45 77.26 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.292 1.037 . . . . 0.0 110.957 174.114 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -61.55 -33.79 74.45 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 118.126 -0.94 . . . . 0.0 112.675 172.395 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -62.96 -47.07 84.77 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 120.408 1.458 . . . . 0.0 112.377 176.384 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.432 ' HB2' ' HE2' ' A' ' 101' ' ' MET . 5.7 mtm -58.78 -47.43 84.75 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.023 0.929 . . . . 0.0 111.631 172.488 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.8 mp -67.06 -38.75 86.36 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 118.033 -0.984 . . . . 0.0 112.305 -179.109 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 7.6 mpt_? -56.04 -24.99 42.98 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-N 120.539 1.518 . . . . 0.0 113.345 171.186 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -93.07 -13.62 28.35 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.057 1.743 . . . . 0.0 114.076 176.188 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 21.6 t30 -131.89 -20.06 2.54 Favored 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 116.579 2.066 . . . . 0.0 116.579 -173.15 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 48.3 tp -133.39 124.05 26.45 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 126.498 1.919 . . . . 0.0 114.693 -169.079 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . 0.321 0.9 OUTLIER 49.63 13.83 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 C-N-CA 129.607 3.163 . . . . 0.0 119.098 168.173 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 4.9 t -166.21 178.13 6.47 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.005 1.722 . . . . 0.0 111.189 176.453 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -112.3 -20.32 11.89 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 115.441 1.645 . . . . 0.0 115.441 176.713 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -174.83 162.99 3.3 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 128.175 2.59 . . . . 0.0 112.465 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 68.7 p . . . . . 0 N--CA 1.486 1.366 0 C-N-CA 127.005 2.122 . . . . 0.0 115.124 169.434 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 200' ' ' 44Z . . . . . 0.488 ' CE5' HG21 ' A' ' 92' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 . . . . . 0 CA--C 1.544 0.722 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -106.43 17.63 6.1 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.0 0 C-N-CA 126.127 1.771 . . . . 0.0 111.793 -170.338 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 53.7 t30 50.56 38.36 18.52 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 125.927 1.691 . . . . 0.0 112.94 -173.357 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 10.1 pm0 -80.78 173.37 12.67 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.728 1.611 . . . . 0.0 113.496 -171.762 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 18.9 m -116.95 167.37 10.12 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 126.033 1.733 . . . . 0.0 112.925 -170.351 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.3 ttp180 -90.76 130.21 41.73 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 124.876 1.27 . . . . 0.0 112.258 -174.341 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -70.38 176.51 7.14 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 124.09 3.194 . . . . 0.0 112.872 169.842 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -58.8 144.17 44.93 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.871 0.868 . . . . 0.0 109.786 173.283 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 86.1 mt -63.43 -38.6 41.2 Favored Pre-proline 0 N--CA 1.476 0.856 0 N-CA-C 114.697 1.369 . . . . 0.0 114.697 -169.294 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -62.98 -33.34 74.75 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 121.686 1.591 . . . . 0.0 113.217 170.683 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 8.8 tt -68.97 -45.19 71.29 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.387 0.994 . . . . 0.0 111.048 176.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.4 tt -52.33 -38.99 60.07 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.97 0.908 . . . . 0.0 111.333 169.724 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.59 -28.06 68.86 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.893 1.071 . . . . 0.0 113.893 176.44 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 65.2 mt -68.63 -40.41 81.73 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 CA-C-N 119.362 0.983 . . . . 0.0 110.648 171.122 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.7 mp -64.96 -37.6 88.17 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.144 -0.972 . . . . 0.0 111.005 173.658 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 17.9 m170 -64.09 -40.01 95.3 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.63 -0.669 . . . . 0.0 111.771 172.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.87 -29.34 70.54 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.991 0.917 . . . . 0.0 113.01 173.87 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.404 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -73.28 -2.49 22.19 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.227 1.011 . . . . 0.0 113.488 171.334 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.93 7.31 64.47 Favored Glycine 0 CA--C 1.536 1.361 0 C-N-CA 125.729 1.633 . . . . 0.0 114.978 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -106.56 109.45 21.37 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 118.777 1.289 . . . . 0.0 112.282 -175.876 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.8 tm0? -69.84 141.82 53.18 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.22 0.608 . . . . 0.0 110.149 170.147 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 172.01 168.17 33.13 Favored Glycine 0 N--CA 1.466 0.695 0 C-N-CA 123.595 0.617 . . . . 0.0 114.478 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -128.08 -57.91 1.23 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.389 1.476 . . . . 0.0 111.293 179.18 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 24.0 mtm -106.06 125.71 51.32 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.846 1.658 . . . . 0.0 111.876 -177.26 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -139.21 145.23 39.02 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.256 1.022 . . . . 0.0 113.417 -173.507 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 52.9 p -88.38 174.66 8.02 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 125.482 1.513 . . . . 0.0 111.848 169.663 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 2.6 t -56.25 -46.03 81.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 120.441 -1.412 . . . . 0.0 109.837 168.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 63.4 tttm -58.75 -40.49 84.0 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.871 0.868 . . . . 0.0 112.423 -179.154 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -74.98 -36.41 62.02 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 175.469 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 67.6 t -67.36 -58.35 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 CA-C-O 117.78 -1.105 . . . . 0.0 110.998 176.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.409 ' SD ' ' CD2' ' A' ' 200' ' ' 44Z . 16.1 mmt -60.59 -30.53 69.87 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-N 120.744 1.611 . . . . 0.0 112.889 -173.475 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -54.49 -59.09 5.15 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.704 173.323 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -74.72 -32.85 62.25 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 175.631 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.85 -40.67 60.87 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 120.801 -1.187 . . . . 0.0 112.043 -177.328 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.48 -40.69 99.05 Favored Glycine 0 CA--C 1.529 0.913 0 N-CA-C 111.604 -0.598 . . . . 0.0 111.604 171.494 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.8 tp60 -60.65 -45.01 95.71 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.13 0.972 . . . . 0.0 112.07 171.338 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.404 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 46.4 t80 -60.42 -51.6 68.81 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.347 1.059 . . . . 0.0 110.488 176.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 45.8 mt -61.58 -37.58 78.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 C-N-CA 124.024 0.929 . . . . 0.0 110.626 179.401 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -67.5 -42.28 83.1 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 119.425 1.011 . . . . 0.0 113.292 175.749 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.8 p -78.54 -30.08 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -177.218 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 21.9 mmtp -97.2 -12.4 23.07 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 125.112 1.365 . . . . 0.0 113.889 177.067 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.0 mp0 51.82 78.4 0.12 Allowed 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 126.95 2.1 . . . . 0.0 114.343 -176.061 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.6 tp -95.11 2.12 55.07 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.403 1.081 . . . . 0.0 112.884 177.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -102.04 162.17 13.12 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 127.627 2.371 . . . . 0.0 110.981 174.412 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -92.34 132.63 36.57 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 168.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.98 -29.02 64.91 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.165 0.893 . . . . 0.0 113.101 -176.627 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -78.34 -25.59 46.46 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.466 1.106 . . . . 0.0 111.862 -174.567 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -143.96 63.7 1.33 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 127.411 2.284 . . . . 0.0 110.127 -169.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -60.55 -20.0 59.03 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.823 0.849 . . . . 0.0 113.178 179.314 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 6.1 p-80 -66.28 -7.4 18.41 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.195 1.398 . . . . 0.0 113.867 169.411 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.6 ttm -124.95 143.48 50.86 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.438 1.895 . . . . 0.0 111.846 174.752 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.0 t -129.17 141.31 46.93 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 126.535 1.934 . . . . 0.0 108.878 -174.654 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -122.85 71.34 1.04 Allowed 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.582 1.153 . . . . 0.0 111.394 -171.336 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 3.5 m -87.71 8.1 27.08 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.185 1.18 . . . . 0.0 114.185 -173.092 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.42 -27.38 63.22 Favored Glycine 0 CA--C 1.54 1.6 0 O-C-N 120.852 -1.155 . . . . 0.0 114.64 179.009 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -89.43 3.89 83.91 Favored Glycine 0 CA--C 1.54 1.617 0 C-N-CA 125.186 1.374 . . . . 0.0 115.172 172.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -109.28 173.22 6.42 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.97 1.708 . . . . 0.0 112.508 -175.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.1 mp -53.17 -32.93 50.37 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.765 1.626 . . . . 0.0 113.041 169.88 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 95.8 mt -61.08 -47.51 85.99 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.102 -0.999 . . . . 0.0 111.397 170.672 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -63.61 -38.28 96.02 Favored Glycine 0 CA--C 1.531 1.053 0 CA-C-O 119.064 -0.853 . . . . 0.0 113.031 173.691 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.16 -29.24 62.71 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 119.903 1.851 . . . . 0.0 112.951 179.676 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.4 pp -80.66 -35.19 34.17 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 175.185 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.08 -7.49 23.16 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 119.266 0.939 . . . . 0.0 113.517 -177.817 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.08 -27.04 3.16 Favored Glycine 0 CA--C 1.541 1.659 0 O-C-N 120.164 -1.585 . . . . 0.0 113.35 -169.635 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.27 137.47 7.12 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 128.092 2.557 . . . . 0.0 110.789 177.831 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -144.75 56.36 1.27 Allowed 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 119.003 0.82 . . . . 0.0 110.608 169.331 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 6.7 m -102.78 129.24 49.37 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 168.445 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 52.3 p90 -163.4 173.8 12.75 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.693 1.197 . . . . 0.0 112.857 -168.057 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 52.9 p -119.97 146.14 46.11 Favored 'General case' 0 C--N 1.333 -0.139 0 C-N-CA 123.87 0.868 . . . . 0.0 112.984 172.602 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 14.4 m -77.68 -14.02 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 C-N-CA 123.157 0.583 . . . . 0.0 112.435 169.562 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 22.6 ttpp -64.73 -28.61 69.7 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.357 1.863 . . . . 0.0 112.598 169.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -117.55 77.47 10.72 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 126.46 1.904 . . . . 0.0 110.003 177.044 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -69.78 -24.78 29.18 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 123.613 2.875 . . . . 0.0 115.023 -169.742 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 48.8 m -60.4 -52.75 70.73 Favored Pre-proline 0 N--CA 1.477 0.886 0 CA-C-N 120.11 1.323 . . . . 0.0 114.124 -177.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -64.54 -32.33 59.18 Favored 'Trans proline' 0 CA--C 1.539 0.765 0 C-N-CA 122.109 1.872 . . . . 0.0 113.081 175.621 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 19.6 tp -65.38 -43.39 90.86 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 121.247 -0.908 . . . . 0.0 111.046 173.678 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -63.85 -37.4 87.26 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.745 0.818 . . . . 0.0 112.223 174.642 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -62.71 -47.51 83.28 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.836 0.854 . . . . 0.0 112.655 174.419 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.445 ' HB2' ' HE3' ' A' ' 101' ' ' MET . 32.0 mtm -58.99 -46.72 87.44 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.211 0.604 . . . . 0.0 112.223 171.868 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 59.0 mt -58.55 -47.18 85.07 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.064 0.946 . . . . 0.0 111.821 177.065 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 34.9 mtp180 -54.46 -25.11 23.22 Favored 'General case' 0 N--CA 1.482 1.168 0 CA-C-N 119.768 1.167 . . . . 0.0 113.535 173.059 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -91.55 -15.41 28.74 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 126.259 1.823 . . . . 0.0 114.655 176.331 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 14.6 p30 -116.29 -23.14 8.5 Favored 'General case' 0 N--CA 1.483 1.225 0 CA-C-N 120.485 1.493 . . . . 0.0 114.587 179.372 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 30.0 tp -113.26 95.84 5.59 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 128.405 2.682 . . . . 0.0 106.101 169.624 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 45.2 t -61.63 129.67 24.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.588 0.755 . . . . 0.0 110.477 -169.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 2.7 t -155.72 -164.01 1.63 Allowed 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.962 1.305 . . . . 0.0 110.765 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 7.5 mp -65.69 -160.43 0.02 OUTLIER 'General case' 0 CA--C 1.557 1.217 0 C-N-CA 127.401 2.28 . . . . 0.0 109.108 167.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . 62.35 18.29 10.14 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 116.469 2.025 . . . . 0.0 116.469 169.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 3.8 t . . . . . 0 N--CA 1.478 0.939 0 C-N-CA 125.677 1.591 . . . . 0.0 111.938 174.93 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 200' ' ' 44Z . . . . . 0.409 ' CD2' ' SD ' ' A' ' 53' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 50.6 mm-40 . . . . . 0 CA--C 1.541 0.625 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.8 pp -82.59 162.54 3.27 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 C-N-CA 125.852 1.661 . . . . 0.0 112.495 174.434 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 28.4 m120 -101.78 3.04 39.05 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.678 1.191 . . . . 0.0 113.616 -178.735 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.81 168.28 18.17 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.634 1.574 . . . . 0.0 113.044 -172.361 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 31.7 m -104.23 172.79 1.46 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 C-N-CA 128.161 2.585 . . . . 0.0 112.07 -174.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 95.4 mtm-85 -86.18 149.42 49.88 Favored Pre-proline 0 N--CA 1.48 1.037 0 O-C-N 121.004 -1.06 . . . . 0.0 111.217 -177.658 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -73.19 174.65 11.71 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 123.155 2.57 . . . . 0.0 111.823 169.776 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt -62.94 148.46 47.4 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.406 1.082 . . . . 0.0 110.054 177.112 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 94.0 mt -55.74 -46.73 99.7 Favored Pre-proline 0 N--CA 1.476 0.832 0 N-CA-C 115.24 1.57 . . . . 0.0 115.24 -168.057 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -66.4 -23.54 50.95 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 CA-C-N 122.509 1.932 . . . . 0.0 114.247 175.599 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.3 tt -71.78 -39.97 69.57 Favored 'General case' 0 N--CA 1.474 0.725 0 O-C-N 120.85 -1.156 . . . . 0.0 109.932 170.01 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 13.6 tp -61.58 -34.58 75.86 Favored 'General case' 0 CA--C 1.548 0.895 0 O-C-N 121.12 -0.987 . . . . 0.0 111.665 170.732 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.419 ' HA ' ' HE2' ' A' ' 35' ' ' LYS . 8.5 mmpt? -65.43 -39.34 91.97 Favored 'General case' 0 N--CA 1.481 1.095 0 O-C-N 121.147 -0.971 . . . . 0.0 112.649 170.012 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 52.6 mt -63.57 -38.88 83.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 124.401 1.08 . . . . 0.0 111.844 172.686 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.9 mt -61.52 -41.04 96.72 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 121.058 -1.026 . . . . 0.0 112.235 169.543 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 49.4 m170 -64.68 -41.93 95.7 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 121.494 -0.754 . . . . 0.0 112.209 172.662 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.91 -25.0 67.7 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.774 1.23 . . . . 0.0 113.331 177.457 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.424 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -71.44 -6.5 40.84 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.904 0.881 . . . . 0.0 113.313 171.684 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.03 12.73 59.9 Favored Glycine 0 CA--C 1.536 1.388 0 C-N-CA 125.177 1.37 . . . . 0.0 114.453 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -108.92 163.16 13.53 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.533 1.533 . . . . 0.0 112.813 -178.198 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -79.99 172.54 13.63 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 121.63 -0.669 . . . . 0.0 110.934 168.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -153.44 102.44 0.22 Allowed Glycine 0 N--CA 1.469 0.841 0 O-C-N 121.373 -0.829 . . . . 0.0 114.252 177.52 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -150.12 85.62 1.41 Allowed 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 126.805 2.042 . . . . 0.0 107.384 170.649 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.1 mpp? 67.22 135.46 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 131.49 3.916 . . . . 0.0 116.256 176.751 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -161.76 169.34 21.59 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.138 1.375 . . . . 0.0 112.788 177.309 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 82.1 p -91.09 171.65 9.11 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 126.55 1.94 . . . . 0.0 111.954 172.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -51.19 -42.23 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.317 0 O-C-N 121.288 -0.883 . . . . 0.0 111.537 172.785 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -62.57 -48.19 80.53 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.367 1.067 . . . . 0.0 112.544 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -73.64 -31.56 63.57 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -178.475 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 57.9 t -64.91 -46.31 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 O-C-N 121.615 -0.678 . . . . 0.0 110.647 169.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.9 ttm -69.29 -32.67 71.98 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 126.2 1.8 . . . . 0.0 114.114 -177.345 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -51.48 -49.7 61.3 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 122.974 0.51 . . . . 0.0 111.137 169.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 42.3 m-85 -74.71 -36.7 62.69 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 115.04 1.496 . . . . 0.0 115.04 171.76 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.1 mp -71.77 -36.95 70.52 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 120.87 1.668 . . . . 0.0 113.435 -177.42 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.13 -42.1 99.56 Favored Glycine 0 CA--C 1.533 1.18 0 CA-C-N 119.246 0.93 . . . . 0.0 111.688 170.516 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.9 tp60 -62.14 -42.69 99.5 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.644 1.178 . . . . 0.0 112.317 172.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.424 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 50.4 t80 -62.17 -52.34 64.2 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.743 1.217 . . . . 0.0 110.2 176.432 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 69.0 mt -58.68 -39.61 76.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 C-N-CA 123.954 0.902 . . . . 0.0 110.752 178.692 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.3 tpt -65.8 -44.19 86.41 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.351 1.06 . . . . 0.0 112.902 175.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.0 p -78.49 -27.77 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 CA-C-N 119.809 1.186 . . . . 0.0 113.399 -177.472 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 54.4 mmtt -89.73 -15.74 31.83 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.108 1.363 . . . . 0.0 113.268 173.601 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 13.9 mp0 51.86 57.88 6.05 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.815 2.046 . . . . 0.0 112.268 -171.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 13.8 tp -91.88 0.93 57.46 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.393 1.077 . . . . 0.0 112.533 -174.733 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 41.5 p90 -92.62 156.43 17.1 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.854 1.662 . . . . 0.0 111.177 171.797 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -80.41 122.71 27.3 Favored 'General case' 0 CA--C 1.541 0.634 0 O-C-N 121.579 -0.7 . . . . 0.0 110.86 172.411 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -59.53 -23.85 63.18 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 114.683 1.364 . . . . 0.0 114.683 177.842 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -91.35 -27.81 18.12 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 123.96 0.904 . . . . 0.0 112.154 -173.443 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -147.03 87.73 1.7 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.844 2.457 . . . . 0.0 109.605 178.328 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 29.6 mp0 -64.43 -12.03 39.22 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 -169.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 28.1 p80 -65.66 -24.79 67.11 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 170.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 20.6 tpp -86.14 132.02 34.12 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.239 1.416 . . . . 0.0 111.629 177.382 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 3.7 t -127.09 125.71 66.85 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 C-N-CA 127.01 2.124 . . . . 0.0 109.49 178.477 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 23.2 t80 -101.14 46.84 0.93 Allowed 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.64 1.176 . . . . 0.0 113.244 -169.626 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 85.2 m -64.88 -9.65 22.58 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 120.467 -1.396 . . . . 0.0 113.848 -179.507 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -54.98 -22.79 29.13 Favored Glycine 0 CA--C 1.541 1.687 0 C-N-CA 124.78 1.181 . . . . 0.0 113.776 169.551 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -86.72 1.98 87.15 Favored Glycine 0 CA--C 1.541 1.71 0 C-N-CA 125.228 1.394 . . . . 0.0 116.148 173.904 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -131.69 -173.62 3.18 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 120.1 1.95 . . . . 0.0 113.769 -175.217 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 7.5 mp -47.15 -40.52 15.89 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.949 1.699 . . . . 0.0 113.532 179.081 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.5 tp -68.57 -32.4 72.29 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-O 121.617 0.722 . . . . 0.0 111.256 178.625 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -73.15 -36.0 56.74 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 126.64 2.067 . . . . 0.0 114.51 173.442 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -66.37 -42.36 88.09 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.861 1.83 . . . . 0.0 110.161 170.857 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 27.7 tp -59.25 -51.45 69.93 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.677 1.191 . . . . 0.0 112.332 178.525 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.22 -10.98 26.74 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 114.91 1.448 . . . . 0.0 114.91 -177.303 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.0 -20.04 7.06 Favored Glycine 0 CA--C 1.539 1.584 0 C-N-CA 125.931 1.729 . . . . 0.0 115.638 -179.496 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.09 30.57 0.49 Allowed 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -175.207 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 5.6 tp60 -70.45 44.79 0.08 Allowed 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 116.4 2.0 . . . . 0.0 116.4 -168.409 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 21.2 m -105.61 138.36 41.94 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 120.778 -1.201 . . . . 0.0 108.973 169.378 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 45.7 p90 -157.24 167.94 28.87 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 -167.528 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 50.1 m -115.09 136.02 53.57 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 113.936 -1.484 . . . . 0.0 109.841 175.3 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.538 HG21 ' CE5' ' A' ' 200' ' ' 44Z . 24.4 m -77.53 -20.05 14.05 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.344 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -178.823 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -74.8 -6.25 47.94 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 126.484 1.913 . . . . 0.0 115.171 -178.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -121.16 87.89 44.66 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 126.439 1.896 . . . . 0.0 109.476 -177.545 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -63.33 -31.34 73.35 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 123.93 3.086 . . . . 0.0 115.273 -169.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 70.0 m -61.5 -55.91 38.34 Favored Pre-proline 0 N--CA 1.477 0.89 0 CA-C-N 120.12 1.327 . . . . 0.0 113.825 -177.248 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -67.17 -27.17 41.81 Favored 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 121.817 1.678 . . . . 0.0 112.63 175.219 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.416 HD11 ' CE3' ' A' ' 200' ' ' 44Z . 27.9 tp -65.55 -45.93 81.5 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.634 0.774 . . . . 0.0 111.158 175.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -63.48 -36.33 83.4 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.627 -0.671 . . . . 0.0 112.564 173.129 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -59.92 -46.3 89.8 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 119.355 0.98 . . . . 0.0 112.079 176.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.403 ' HE3' ' HB2' ' A' ' 101' ' ' MET . 29.0 mtm -62.09 -49.86 74.25 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 171.637 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -64.94 -46.76 80.23 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 118.042 -0.98 . . . . 0.0 111.053 -171.569 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -58.19 -23.6 56.11 Favored 'General case' 0 N--CA 1.482 1.14 0 CA-C-N 119.975 1.261 . . . . 0.0 113.338 175.822 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -90.49 -18.74 24.78 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.968 1.707 . . . . 0.0 114.806 174.842 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -121.86 -26.68 4.78 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-N 119.843 1.201 . . . . 0.0 114.145 -171.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 3.3 tt -124.79 96.2 4.8 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 127.631 2.373 . . . . 0.0 107.188 174.703 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 33.5 t -58.58 132.24 23.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 C-N-CA 123.623 0.769 . . . . 0.0 111.069 -170.1 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 6.3 t -148.28 -174.76 4.67 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.152 1.381 . . . . 0.0 111.948 -172.42 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -91.88 26.86 2.27 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.498 1.919 . . . . 0.0 115.503 -168.906 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -139.12 157.14 46.48 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.825 1.25 . . . . 0.0 114.269 -172.707 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 8.9 t . . . . . 0 N--CA 1.479 0.992 0 C-N-CA 125.651 1.58 . . . . 0.0 113.795 -176.159 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 200' ' ' 44Z . . . . . 0.538 ' CE5' HG21 ' A' ' 92' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 . . . . . 0 CA--C 1.542 0.671 0 N-CA-C 112.489 0.551 . . . . 0.0 112.489 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.7 mt -133.04 151.56 34.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 125.873 1.669 . . . . 0.0 109.558 -179.275 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 69.2 m-80 -107.74 49.85 0.79 Allowed 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.424 1.49 . . . . 0.0 111.036 172.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 7.9 pm0 -80.75 166.63 20.82 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.669 1.587 . . . . 0.0 113.209 -176.424 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 17.8 m -131.66 157.48 43.17 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 125.573 1.549 . . . . 0.0 113.526 -169.265 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 30.9 ttm105 -86.69 143.1 35.26 Favored Pre-proline 0 N--CA 1.48 1.075 0 C-N-CA 124.796 1.238 . . . . 0.0 112.56 -172.354 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -65.81 166.83 19.09 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 122.606 2.204 . . . . 0.0 111.953 168.33 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 27.8 ttpt -72.53 157.67 37.15 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 170.138 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.3 mp -50.4 -47.5 83.27 Favored Pre-proline 0 N--CA 1.473 0.696 0 N-CA-C 115.252 1.575 . . . . 0.0 115.252 -168.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_exo -66.19 -28.99 47.79 Favored 'Trans proline' 0 C--N 1.348 0.522 0 CA-C-N 121.689 1.639 . . . . 0.0 113.732 178.414 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.4 tt -74.11 -38.62 63.77 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.37 -0.831 . . . . 0.0 109.606 177.266 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 23.1 tp -60.2 -35.59 75.75 Favored 'General case' 0 CA--C 1.55 0.956 0 O-C-N 121.521 -0.737 . . . . 0.0 111.341 170.115 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.4 mmtp -69.62 -36.51 76.21 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 121.386 -0.821 . . . . 0.0 112.552 174.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.29 -38.65 81.66 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.495 0.718 . . . . 0.0 110.921 170.773 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.5 mp -64.13 -39.95 95.14 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.029 -1.045 . . . . 0.0 113.116 171.155 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 35.6 m170 -58.81 -47.32 85.17 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 119.592 1.087 . . . . 0.0 111.497 170.087 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.16 -25.15 68.22 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 177.098 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.469 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -67.62 -15.22 63.54 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.067 0.947 . . . . 0.0 113.322 172.958 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 89.47 12.59 62.68 Favored Glycine 0 CA--C 1.537 1.413 0 C-N-CA 125.06 1.314 . . . . 0.0 113.883 -169.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -98.67 157.5 16.22 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.893 1.277 . . . . 0.0 111.662 176.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.8 tp60 -80.38 164.42 23.11 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.658 0.783 . . . . 0.0 111.36 174.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -82.08 -156.78 18.86 Favored Glycine 0 CA--C 1.537 1.462 0 N-CA-C 115.809 1.084 . . . . 0.0 115.809 174.81 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 61.0 66.16 0.93 Allowed 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 127.611 2.364 . . . . 0.0 116.592 173.39 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . 0.401 0.9 OUTLIER 51.38 146.05 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.275 1 N-CA-C 121.967 4.062 . . . . 0.0 121.967 168.307 . . . . . . . . 4 3 . 1 . 013 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -157.53 172.15 19.08 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.559 1.543 . . . . 0.0 112.596 -168.416 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 40.0 p -81.66 168.78 17.77 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 124.475 1.11 . . . . 0.0 112.067 171.058 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -57.92 -41.06 79.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 120.22 -1.55 . . . . 0.0 110.663 172.406 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -59.42 -31.77 69.58 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.666 0.786 . . . . 0.0 112.709 178.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -80.55 -53.16 6.81 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.082 0.953 . . . . 0.0 112.903 170.508 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 88.5 t -56.08 -52.3 51.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 123.776 0.83 . . . . 0.0 111.275 -176.42 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 26.7 mmm -73.15 -30.64 63.73 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -172.399 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 54.9 t-80 -61.58 -48.24 81.83 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.583 170.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -64.54 -38.95 92.79 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 121.743 -0.598 . . . . 0.0 112.389 173.596 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.98 -38.78 92.11 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 121.187 -0.946 . . . . 0.0 111.448 175.055 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.74 -39.14 97.17 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 125.385 1.469 . . . . 0.0 112.885 172.812 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 11.9 tp60 -60.94 -48.64 80.87 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.757 1.223 . . . . 0.0 111.091 169.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.469 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 33.5 t80 -56.54 -48.96 76.17 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.122 -0.986 . . . . 0.0 110.735 174.218 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 47.0 mt -59.63 -36.76 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 125.228 1.411 . . . . 0.0 111.935 177.731 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.5 tpt -68.12 -36.5 79.84 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.718 1.207 . . . . 0.0 112.231 174.194 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 94.2 t -78.18 -33.41 17.84 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 124.063 0.945 . . . . 0.0 112.677 178.458 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 48.2 mmtt -89.84 -14.82 33.56 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.752 1.221 . . . . 0.0 113.222 178.016 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.6 mp0 50.02 63.94 1.99 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 127.627 2.371 . . . . 0.0 113.088 -171.866 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 14.3 tp -91.26 -1.59 57.64 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.149 0.98 . . . . 0.0 113.295 -175.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 55.1 p90 -90.25 156.22 18.45 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.551 1.54 . . . . 0.0 111.923 178.345 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -76.83 128.64 34.97 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.816 -0.553 . . . . 0.0 111.136 171.543 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.6 pm0 -69.68 -27.22 64.83 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 115.271 1.582 . . . . 0.0 115.271 -171.171 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -96.08 -26.92 15.32 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 119.165 0.893 . . . . 0.0 111.891 -177.315 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -136.19 79.75 1.79 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.669 1.988 . . . . 0.0 111.178 176.646 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 29.7 mp0 -60.89 -12.73 12.0 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -173.428 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 23.9 p80 -62.38 -25.76 68.1 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 118.94 0.791 . . . . 0.0 112.786 170.647 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 18.2 tpp -83.6 129.17 34.96 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.069 1.347 . . . . 0.0 110.955 172.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.4 t -119.01 117.57 54.73 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 125.991 1.716 . . . . 0.0 107.856 174.36 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -102.09 65.74 0.99 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.213 1.005 . . . . 0.0 112.165 -169.11 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 2.7 m -79.32 3.91 16.77 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 114.258 1.207 . . . . 0.0 114.258 -173.473 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.95 -26.08 54.48 Favored Glycine 0 CA--C 1.542 1.727 0 CA-C-N 119.927 1.24 . . . . 0.0 114.316 171.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -91.68 7.34 79.68 Favored Glycine 0 CA--C 1.542 1.738 0 C-N-CA 125.437 1.494 . . . . 0.0 115.374 172.734 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -112.74 170.31 8.28 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.181 1.792 . . . . 0.0 112.537 -174.13 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.9 tt -46.53 -43.17 16.72 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.63 1.572 . . . . 0.0 111.089 169.499 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 96.3 mt -55.13 -43.23 73.93 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.248 1.019 . . . . 0.0 112.522 173.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -70.64 -39.1 67.61 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 124.984 1.278 . . . . 0.0 113.62 177.275 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -63.52 -42.61 98.46 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 120.363 2.082 . . . . 0.0 110.696 174.074 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 40.2 tp -62.7 -51.59 66.6 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.976 1.711 . . . . 0.0 112.52 -178.477 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -97.26 -8.48 29.73 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 -176.251 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 82.69 -24.68 4.94 Favored Glycine 0 CA--C 1.54 1.613 0 C-N-CA 125.492 1.52 . . . . 0.0 113.126 -169.698 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.18 137.21 10.39 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 127.049 2.14 . . . . 0.0 111.611 175.588 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -148.44 45.1 1.04 Allowed 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.153 0.981 . . . . 0.0 110.161 169.05 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 11.5 m -99.51 131.17 45.69 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 120.933 -1.104 . . . . 0.0 110.368 170.115 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 35.7 p90 -165.16 178.78 6.74 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.589 1.555 . . . . 0.0 111.98 -168.632 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 77.3 p -127.21 143.88 51.16 Favored 'General case' 0 N--CA 1.456 -0.162 0 N-CA-C 114.63 1.345 . . . . 0.0 114.63 174.157 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.456 HG21 ' CE5' ' A' ' 200' ' ' 44Z . 21.3 m -72.1 -16.84 18.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 N-CA-C 114.042 1.127 . . . . 0.0 114.042 -173.792 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.5 pttt -74.43 -9.49 58.64 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.854 1.662 . . . . 0.0 114.108 172.566 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -121.09 79.84 34.59 Favored Pre-proline 0 CA--C 1.549 0.906 0 C-N-CA 126.091 1.757 . . . . 0.0 110.154 -179.036 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.14 -28.52 28.11 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 123.449 2.766 . . . . 0.0 114.712 -169.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 59.2 m -57.51 -54.14 58.17 Favored Pre-proline 0 N--CA 1.477 0.882 0 CA-C-N 120.147 1.339 . . . . 0.0 113.721 -177.775 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -66.16 -27.26 49.17 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 121.889 1.726 . . . . 0.0 112.854 174.323 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.21 -53.41 57.31 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.255 1.022 . . . . 0.0 110.568 175.295 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -63.77 -32.45 73.96 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.72 0.808 . . . . 0.0 112.52 173.616 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -62.47 -43.85 97.81 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 120.123 1.329 . . . . 0.0 112.844 175.116 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 23.5 mtm -63.5 -49.67 72.64 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.023 0.529 . . . . 0.0 111.729 171.475 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.8 mp -62.43 -36.78 83.46 Favored 'General case' 0 C--O 1.219 -0.547 0 CA-C-O 117.696 -1.145 . . . . 0.0 111.808 -177.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 -55.1 -24.49 25.9 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 121.336 1.88 . . . . 0.0 113.662 171.804 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -89.99 -15.08 32.65 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 125.367 1.467 . . . . 0.0 114.559 173.071 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -132.37 2.69 3.88 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 115.595 1.702 . . . . 0.0 115.595 -177.528 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 62.0 tp -145.78 143.36 29.65 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 128.251 2.62 . . . . 0.0 108.573 -178.705 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 65.2 t -75.96 95.49 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 171.82 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 5.9 t -156.55 -174.14 4.8 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.432 1.493 . . . . 0.0 111.767 -175.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -104.35 169.54 8.42 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 127.386 2.275 . . . . 0.0 110.626 -176.21 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -84.53 4.57 31.36 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 115.712 1.745 . . . . 0.0 115.712 -174.561 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 78.1 p . . . . . 0 N--CA 1.471 0.588 0 C-N-CA 125.454 1.501 . . . . 0.0 112.17 -168.167 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 200' ' ' 44Z . . . . . 0.456 ' CE5' HG21 ' A' ' 92' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 . . . . . 0 CA--C 1.542 0.672 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 57.7 mt -109.76 138.69 36.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 125.4 1.48 . . . . 0.0 109.686 -179.458 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 51.4 t-20 -76.26 110.35 10.7 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.793 0.837 . . . . 0.0 110.609 173.603 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -151.98 171.84 17.19 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.821 1.648 . . . . 0.0 111.827 -179.407 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.6 m -127.77 172.2 14.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 126.252 1.821 . . . . 0.0 111.84 -178.711 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -81.8 140.91 47.34 Favored Pre-proline 0 N--CA 1.481 1.121 0 C-N-CA 124.547 1.139 . . . . 0.0 112.941 -169.131 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -70.28 175.6 8.31 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 123.793 2.995 . . . . 0.0 113.791 175.003 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 17.3 ttmt -60.56 147.27 42.14 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.564 1.145 . . . . 0.0 109.617 172.253 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 73.6 mt -57.12 -47.05 99.73 Favored Pre-proline 0 N--CA 1.474 0.744 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 -167.902 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -66.82 -23.63 47.71 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 CA-C-N 121.8 1.679 . . . . 0.0 114.609 176.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.409 ' C ' HD23 ' A' ' 33' ' ' LEU . 5.6 tt -65.92 -44.11 86.12 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 120.057 1.299 . . . . 0.0 109.31 172.61 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 36.6 tp -62.13 -39.99 94.42 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 121.738 -0.601 . . . . 0.0 111.729 172.853 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.8 mmpt? -61.28 -39.81 91.81 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.339 0.655 . . . . 0.0 112.698 174.04 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 63.5 mt -64.33 -35.56 74.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 124.355 1.062 . . . . 0.0 112.224 174.402 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.1 mt -70.65 -34.87 72.51 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 119.666 1.121 . . . . 0.0 111.944 171.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 50.9 m170 -61.19 -42.32 98.36 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.053 0.842 . . . . 0.0 111.275 169.48 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.66 -24.86 67.72 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.512 1.125 . . . . 0.0 113.513 175.023 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.458 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -71.51 -7.02 44.91 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 124.155 0.982 . . . . 0.0 113.141 171.284 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 85.49 12.78 71.92 Favored Glycine 0 CA--C 1.537 1.421 0 C-N-CA 125.205 1.383 . . . . 0.0 114.146 -173.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -106.3 140.9 38.51 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.955 1.302 . . . . 0.0 112.637 -176.379 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -76.66 162.55 27.64 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 121.721 -0.612 . . . . 0.0 110.479 169.036 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -162.99 130.42 2.24 Favored Glycine 0 CA--C 1.526 0.747 0 O-C-N 121.432 -0.792 . . . . 0.0 114.982 -178.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -142.17 66.68 1.33 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 126.227 1.811 . . . . 0.0 109.162 173.276 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . 0.419 0.6 OUTLIER 63.38 145.86 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 129.537 3.135 . . . . 0.0 118.191 -175.013 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -162.72 169.55 19.81 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.089 1.756 . . . . 0.0 113.07 -168.745 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 41.8 p -79.96 171.37 15.19 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 125.244 1.418 . . . . 0.0 112.01 169.5 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -59.52 -39.19 78.68 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 O-C-N 120.549 -1.345 . . . . 0.0 111.676 173.736 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -62.18 -45.57 92.82 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.272 1.429 . . . . 0.0 112.724 176.364 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -68.76 -38.88 80.42 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.259 0.624 . . . . 0.0 112.176 176.677 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 8.5 t -58.37 -45.3 89.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 124.689 1.196 . . . . 0.0 111.126 170.177 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -69.3 -33.97 73.98 Favored 'General case' 0 CA--C 1.519 -0.242 0 C-N-CA 126.942 2.097 . . . . 0.0 114.512 -172.425 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -51.56 -49.29 62.32 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 120.699 0.285 . . . . 0.0 111.149 169.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -74.77 -32.26 62.01 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 172.207 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.91 -40.79 78.89 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 120.431 1.469 . . . . 0.0 112.43 178.873 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -60.18 -45.62 95.71 Favored Glycine 0 CA--C 1.529 0.919 0 N-CA-C 111.269 -0.732 . . . . 0.0 111.269 171.524 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 11.0 tp60 -58.32 -42.61 87.12 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.269 1.028 . . . . 0.0 112.582 173.294 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.458 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 56.3 t80 -61.13 -50.12 74.48 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.078 0.951 . . . . 0.0 110.544 174.843 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 72.4 mt -61.44 -37.13 77.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 123.781 0.833 . . . . 0.0 111.154 178.943 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 34.3 mmt -67.58 -42.97 81.65 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 119.502 1.046 . . . . 0.0 113.256 174.183 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.3 p -78.49 -27.42 14.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 CA-C-N 119.738 1.154 . . . . 0.0 113.267 -176.76 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 56.4 mmtt -93.24 -15.69 25.6 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.266 1.427 . . . . 0.0 113.566 174.134 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 14.8 mp0 54.36 61.29 3.09 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.68 1.992 . . . . 0.0 113.022 -175.493 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.2 tp -94.4 10.12 35.6 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.48 1.112 . . . . 0.0 112.873 -176.415 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 25.1 p90 -113.26 155.43 25.1 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 127.128 2.171 . . . . 0.0 111.49 -178.548 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -80.96 129.64 34.63 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 122.048 -0.408 . . . . 0.0 110.174 169.802 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 7.7 pm0 -59.02 -33.88 71.24 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -173.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -108.02 -27.88 9.88 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.498 1.119 . . . . 0.0 112.185 -171.406 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -109.14 56.5 0.62 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.763 2.025 . . . . 0.0 111.019 171.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -60.71 -18.63 55.43 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 124.494 1.118 . . . . 0.0 113.434 -175.387 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 29.6 p80 -63.26 -14.8 53.56 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.584 1.154 . . . . 0.0 114.013 171.367 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 13.8 ttm -111.64 141.72 44.87 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.007 1.323 . . . . 0.0 112.132 172.063 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.5 t -122.99 133.3 69.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 126.258 1.823 . . . . 0.0 108.821 175.853 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 6.6 t80 -113.32 52.07 0.81 Allowed 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.77 0.795 . . . . 0.0 112.968 -169.529 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 4.9 m -71.52 -6.37 40.12 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 -175.714 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -55.54 -25.54 42.69 Favored Glycine 0 CA--C 1.541 1.657 0 C-N-CA 125.439 1.495 . . . . 0.0 115.148 177.165 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -88.47 0.24 82.95 Favored Glycine 0 CA--C 1.541 1.658 0 C-N-CA 125.051 1.31 . . . . 0.0 115.601 175.246 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -131.92 -176.07 3.93 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 126.067 1.747 . . . . 0.0 112.072 -171.426 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -46.71 -47.05 20.55 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.833 2.053 . . . . 0.0 113.871 -170.806 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 94.0 mt -60.08 -37.81 81.03 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.81 1.244 . . . . 0.0 112.564 175.162 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -73.16 -34.24 58.42 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 125.697 1.617 . . . . 0.0 114.311 175.611 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -66.51 -42.39 87.42 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 119.68 1.74 . . . . 0.0 110.444 171.353 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 32.9 tp -61.53 -50.77 71.33 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.401 1.48 . . . . 0.0 112.524 179.049 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -99.02 -14.27 19.53 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 115.154 1.538 . . . . 0.0 115.154 -175.442 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 82.35 -19.1 11.37 Favored Glycine 0 CA--C 1.541 1.665 0 C-N-CA 125.729 1.633 . . . . 0.0 116.114 179.448 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.0 24.12 1.18 Allowed 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 -176.794 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -71.26 52.65 0.18 Allowed 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 117.533 2.42 . . . . 0.0 117.533 -167.492 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 36.0 m -117.79 139.06 51.6 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.235 1.014 . . . . 0.0 108.53 168.756 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 45.8 p90 -159.34 167.12 29.66 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -167.245 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 2.1 m -99.91 136.29 40.05 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.608 1.563 . . . . 0.0 110.328 169.633 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.55 HG21 ' CD5' ' A' ' 200' ' ' 44Z . 6.9 m -77.6 -19.87 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 124.399 1.079 . . . . 0.0 112.803 175.039 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 61.3 pttt -80.56 -2.94 48.38 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 127.592 2.357 . . . . 0.0 115.114 -179.256 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.401 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 48.9 t0 -125.94 94.26 42.17 Favored Pre-proline 0 CA--C 1.549 0.92 0 C-N-CA 126.592 1.957 . . . . 0.0 110.267 -171.36 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 94' ' ' ASP . 20.3 Cg_endo -61.5 -31.39 87.66 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 123.936 3.091 . . . . 0.0 115.529 -174.799 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 66.8 m -58.53 -53.1 69.65 Favored Pre-proline 0 N--CA 1.477 0.882 0 CA-C-N 119.92 1.236 . . . . 0.0 114.057 -178.097 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -68.39 -24.33 36.99 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 122.034 1.823 . . . . 0.0 113.49 174.692 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 61.5 mt -65.9 -47.08 75.99 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 119.522 1.055 . . . . 0.0 111.058 174.381 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -58.13 -41.3 83.36 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 178.233 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -58.74 -51.72 68.77 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 118.963 0.801 . . . . 0.0 112.487 176.828 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 34.0 mtm -64.16 -49.69 71.09 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.266 0.626 . . . . 0.0 112.287 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.4 mp -63.61 -49.38 73.54 Favored 'General case' 0 C--O 1.224 -0.263 0 C-N-CA 124.568 1.147 . . . . 0.0 110.756 -176.682 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -60.32 -19.21 54.39 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 120.238 1.381 . . . . 0.0 113.647 178.679 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -96.74 -14.14 22.21 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.948 1.699 . . . . 0.0 114.435 175.126 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -118.23 -21.39 8.19 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-N 120.047 1.294 . . . . 0.0 113.742 -178.439 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 43.8 tp -117.36 130.17 56.34 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 127.225 2.21 . . . . 0.0 107.787 169.26 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 62.0 t -71.15 109.44 3.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 175.018 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 10.8 t -157.45 169.14 25.37 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 125.178 1.391 . . . . 0.0 111.537 -178.229 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.555 ' H ' HD13 ' A' ' 109' ' ' LEU . 0.0 OUTLIER -79.08 171.75 14.76 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.367 1.467 . . . . 0.0 114.258 179.908 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -120.64 15.1 11.89 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.827 1.651 . . . . 0.0 114.771 -169.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 8.0 t . . . . . 0 N--CA 1.479 1.003 0 C-N-CA 125.462 1.505 . . . . 0.0 112.955 -174.792 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 200' ' ' 44Z . . . . . 0.55 ' CD5' HG21 ' A' ' 92' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 54.3 mm-40 . . . . . 0 CA--C 1.538 0.511 0 CA-C-O 122.123 0.964 . . . . 0.0 112.794 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 17.4 pt -80.62 163.79 3.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 127.787 2.435 . . . . 0.0 114.29 -175.018 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 40.7 p-10 -86.94 2.49 49.19 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 125.57 1.548 . . . . 0.0 114.356 175.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 30.4 mm100 -78.34 174.58 11.1 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.554 1.541 . . . . 0.0 111.873 175.176 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 35.0 m -124.47 172.09 12.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 125.398 1.479 . . . . 0.0 111.904 -173.352 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 37.6 mtm180 -91.39 145.25 31.04 Favored Pre-proline 0 N--CA 1.479 1.01 0 C-N-CA 124.405 1.082 . . . . 0.0 112.482 -175.255 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -75.78 177.92 8.09 Favored 'Trans proline' 0 CA--C 1.54 0.807 0 C-N-CA 124.152 3.235 . . . . 0.0 111.499 169.324 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.7 ttmt -69.24 148.53 49.68 Favored 'General case' 0 CA--C 1.536 0.442 0 O-C-N 121.638 -0.664 . . . . 0.0 111.237 178.414 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 10.0 mp -53.67 -55.17 38.17 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 125.133 1.373 . . . . 0.0 114.548 -169.236 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -65.46 -22.0 59.7 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 122.297 1.998 . . . . 0.0 113.845 175.755 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.0 tt -75.21 -32.41 61.18 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 119.88 1.218 . . . . 0.0 110.988 172.573 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.3 tp -63.69 -37.31 86.88 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.308 -0.87 . . . . 0.0 111.017 169.189 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.42 ' HA ' ' HE2' ' A' ' 35' ' ' LYS . 8.9 mmpt? -62.61 -37.62 86.96 Favored 'General case' 0 N--CA 1.479 0.998 0 O-C-N 121.674 -0.641 . . . . 0.0 112.34 173.241 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 90.4 mt -62.94 -39.0 83.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 124.067 0.947 . . . . 0.0 111.467 172.507 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.3 mp -70.35 -33.06 71.01 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 120.715 -1.241 . . . . 0.0 113.332 172.175 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 63.5 m170 -64.46 -41.36 96.56 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 120.957 -1.09 . . . . 0.0 111.401 170.388 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.28 -24.12 67.72 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.013 0.925 . . . . 0.0 113.323 172.424 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.488 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -72.09 -9.12 57.97 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 123.955 0.902 . . . . 0.0 113.425 172.158 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.51 7.75 64.75 Favored Glycine 0 CA--C 1.538 1.491 0 C-N-CA 125.4 1.476 . . . . 0.0 114.572 -175.181 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -94.08 166.54 12.08 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.67 1.188 . . . . 0.0 113.08 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.1 tm0? -126.53 144.53 50.84 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.839 1.656 . . . . 0.0 108.973 169.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -174.71 165.48 36.79 Favored Glycine 0 C--N 1.339 0.711 0 N-CA-C 116.496 1.358 . . . . 0.0 116.496 -170.416 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -141.26 -65.38 0.43 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.408 1.883 . . . . 0.0 109.18 169.846 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 25.9 mtm -106.29 142.76 35.43 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 127.811 2.445 . . . . 0.0 112.169 -178.069 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -157.4 162.95 39.03 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.062 0.945 . . . . 0.0 113.419 -173.714 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 81.2 p -94.97 172.85 7.9 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.613 1.165 . . . . 0.0 108.366 166.179 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -57.4 -46.88 85.62 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.426 0 O-C-N 120.082 -1.636 . . . . 0.0 109.817 169.45 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -55.97 -39.89 72.45 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.786 1.234 . . . . 0.0 112.649 -179.181 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -74.2 -37.29 63.93 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 175.588 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 97.0 t -68.71 -49.66 62.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 CA-C-N 119.946 1.248 . . . . 0.0 111.978 175.87 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 11.5 mmm -67.63 -28.05 67.4 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 119.229 0.922 . . . . 0.0 112.99 -170.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -53.44 -54.03 42.77 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 114.84 -1.073 . . . . 0.0 111.355 169.724 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -74.35 -35.22 63.57 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 176.826 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.32 -37.56 77.79 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 121.131 -0.98 . . . . 0.0 112.107 178.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -64.99 -42.82 96.6 Favored Glycine 0 CA--C 1.529 0.929 0 C-N-CA 124.588 1.09 . . . . 0.0 112.054 172.351 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 30.4 tp60 -57.94 -44.54 87.01 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.046 0.938 . . . . 0.0 111.641 169.903 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.488 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 70.9 t80 -60.86 -52.18 66.13 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.505 0.722 . . . . 0.0 111.304 176.257 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 25.8 mt -58.79 -36.83 62.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 124.376 1.07 . . . . 0.0 111.371 177.324 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.6 tpt -66.39 -45.04 81.38 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 125.206 1.402 . . . . 0.0 112.684 175.166 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.7 p -78.51 -27.28 14.14 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 CA-C-N 119.709 1.14 . . . . 0.0 113.488 -177.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 53.7 mmtt -90.97 -15.74 29.18 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 125.287 1.435 . . . . 0.0 113.494 173.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 16.0 mp0 54.69 63.94 1.98 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 127.412 2.285 . . . . 0.0 113.417 -175.749 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.7 mt -91.86 -8.13 47.38 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.59 0.756 . . . . 0.0 113.007 176.133 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 54.2 p90 -76.61 153.39 35.32 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.845 0.858 . . . . 0.0 111.072 170.028 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -82.82 130.81 35.18 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 121.719 -0.613 . . . . 0.0 110.828 171.392 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -64.11 -25.36 68.06 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 120.969 -1.082 . . . . 0.0 113.353 -177.73 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -91.69 -22.72 20.09 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 123.923 0.889 . . . . 0.0 111.671 -172.224 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -149.84 75.42 1.25 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 129.327 3.051 . . . . 0.0 109.662 -174.067 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 29.9 mp0 -60.7 -18.64 55.42 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -173.405 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 1.6 p-80 -63.7 -29.74 70.93 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 113.469 0.915 . . . . 0.0 113.469 169.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 16.9 tpp -81.35 130.01 34.86 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.515 1.126 . . . . 0.0 110.532 171.584 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.5 t -124.81 117.38 50.1 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 C-N-CA 126.099 1.76 . . . . 0.0 108.664 177.8 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -96.77 73.53 2.65 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.165 1.386 . . . . 0.0 110.713 -177.163 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 72.5 m -76.76 -0.81 25.16 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 121.208 -0.932 . . . . 0.0 112.944 171.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.58 -25.63 58.62 Favored Glycine 0 CA--C 1.541 1.685 0 O-C-N 120.557 -1.34 . . . . 0.0 113.879 169.637 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -87.56 3.77 86.19 Favored Glycine 0 CA--C 1.542 1.731 0 C-N-CA 125.32 1.438 . . . . 0.0 115.224 171.312 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -107.57 167.51 9.9 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 126.231 1.812 . . . . 0.0 112.438 -176.372 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.9 tp -46.61 -43.0 17.0 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.184 1.794 . . . . 0.0 111.917 169.152 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 13.9 tp -59.38 -41.35 89.15 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.412 1.485 . . . . 0.0 111.74 175.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -65.16 -42.35 96.49 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 124.935 1.255 . . . . 0.0 113.834 171.306 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -63.33 -47.31 82.74 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 120.211 2.006 . . . . 0.0 110.679 177.475 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.4 pp -70.36 -32.49 70.2 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -176.166 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.15 -9.04 31.58 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 119.783 1.174 . . . . 0.0 112.854 175.228 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 80.43 -26.5 3.03 Favored Glycine 0 CA--C 1.541 1.659 0 C-N-CA 125.909 1.718 . . . . 0.0 113.437 -171.317 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -161.27 134.84 6.61 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 128.741 2.817 . . . . 0.0 109.425 176.25 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -142.6 28.56 1.61 Allowed 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 119.132 0.878 . . . . 0.0 111.32 174.01 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.2 m -91.78 142.69 27.31 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 121.591 -0.693 . . . . 0.0 111.95 -178.572 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 50.0 p90 -160.97 169.44 22.56 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.315 1.046 . . . . 0.0 112.41 -169.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 5.3 t -125.01 136.49 53.76 Favored 'General case' 0 N--CA 1.462 0.148 0 C-N-CA 123.584 0.754 . . . . 0.0 110.755 169.305 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 33.9 m -71.35 -11.69 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 N-CA-C 114.325 1.231 . . . . 0.0 114.325 -174.038 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -73.88 -11.21 60.29 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.338 1.055 . . . . 0.0 113.549 169.489 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 47.0 t0 -121.39 77.71 35.36 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 126.9 2.08 . . . . 0.0 109.303 179.135 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -71.39 -28.26 18.29 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 123.478 2.786 . . . . 0.0 115.017 -169.347 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 49.8 m -57.35 -52.26 75.56 Favored Pre-proline 0 N--CA 1.477 0.898 0 CA-C-N 119.987 1.267 . . . . 0.0 114.25 -177.782 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -66.47 -30.63 43.54 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 122.193 1.929 . . . . 0.0 113.239 176.097 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 40.8 tp -65.55 -48.29 72.93 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.281 1.032 . . . . 0.0 110.312 175.502 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -60.45 -41.48 94.17 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 118.484 -0.769 . . . . 0.0 112.405 172.365 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -58.28 -47.53 83.34 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 120.128 1.331 . . . . 0.0 112.645 -179.717 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 46.0 mtm -66.32 -49.6 66.46 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.461 0.705 . . . . 0.0 112.314 175.643 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.7 mp -65.58 -37.16 85.87 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-O 117.957 -1.021 . . . . 0.0 111.571 -177.212 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 91.4 mtt180 -55.43 -22.7 21.45 Favored 'General case' 0 N--CA 1.484 1.226 0 CA-C-N 120.732 1.606 . . . . 0.0 113.828 169.678 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -92.16 -16.24 26.54 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.792 1.637 . . . . 0.0 113.709 175.592 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -128.72 -10.83 4.96 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 116.185 1.921 . . . . 0.0 116.185 -176.492 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.551 HD23 ' H ' ' A' ' 107' ' ' VAL . 2.1 tt -140.95 164.36 30.46 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.84 2.056 . . . . 0.0 111.315 -167.508 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' VAL . . . . . 0.551 ' H ' HD23 ' A' ' 106' ' ' LEU . 20.8 t -74.81 67.11 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 126.292 1.837 . . . . 0.0 111.117 176.425 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 16.3 m -108.08 141.89 39.09 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 126.026 1.731 . . . . 0.0 110.082 176.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.49 ' H ' HD13 ' A' ' 109' ' ' LEU . 0.0 OUTLIER -89.39 168.09 12.5 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 -178.73 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -126.86 167.73 15.43 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.845 2.058 . . . . 0.0 113.08 -169.439 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 11.8 t . . . . . 0 N--CA 1.479 1.018 0 C-N-CA 124.115 0.966 . . . . 0.0 113.39 175.972 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 200' ' ' 44Z . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 . . . . . 0 CA--C 1.543 0.709 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 38.4 mm -110.06 126.34 67.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 125.151 1.38 . . . . 0.0 110.977 -178.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -140.85 34.94 1.77 Allowed 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 126.894 2.078 . . . . 0.0 110.741 170.325 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -94.37 -179.53 4.95 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 126.107 1.763 . . . . 0.0 112.384 -175.003 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 22.2 m -103.89 163.32 3.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 126.023 1.729 . . . . 0.0 110.907 173.487 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 43.8 mtt180 -92.24 140.7 24.46 Favored Pre-proline 0 N--CA 1.48 1.027 0 C-N-CA 124.098 0.959 . . . . 0.0 111.502 -176.628 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -76.34 176.72 9.7 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 123.667 2.912 . . . . 0.0 111.327 169.578 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt -68.19 153.39 43.84 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.547 0.739 . . . . 0.0 110.58 179.44 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 93.5 mt -60.65 -43.9 93.68 Favored Pre-proline 0 N--CA 1.478 0.946 0 N-CA-C 114.543 1.312 . . . . 0.0 114.543 -169.376 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -65.85 -26.2 52.3 Favored 'Trans proline' 0 C--N 1.353 0.794 0 CA-C-N 121.616 1.613 . . . . 0.0 113.287 172.184 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.39 -42.33 75.27 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.437 1.095 . . . . 0.0 110.948 174.776 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.7 tt -61.12 -36.7 80.45 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 120.969 -1.082 . . . . 0.0 111.292 170.042 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -63.77 -37.95 89.27 Favored 'General case' 0 N--CA 1.482 1.154 0 O-C-N 121.082 -1.011 . . . . 0.0 113.394 169.839 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.8 mt -60.26 -41.63 87.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 CA-C-N 120.238 1.381 . . . . 0.0 111.434 171.05 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.8 mp -66.61 -36.71 83.26 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 119.428 1.013 . . . . 0.0 112.133 174.175 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 28.5 m170 -63.36 -43.17 98.43 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 121.046 -1.034 . . . . 0.0 111.674 172.007 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.66 -28.31 69.83 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.266 1.027 . . . . 0.0 113.042 173.539 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.492 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -69.44 -15.07 63.21 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 124.155 0.982 . . . . 0.0 113.302 172.471 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 102.23 8.17 44.82 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 125.997 1.76 . . . . 0.0 114.884 -176.242 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -95.95 173.38 7.46 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 118.803 1.301 . . . . 0.0 113.901 -176.594 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.5 tm0? -136.77 143.28 43.15 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.921 1.688 . . . . 0.0 109.248 169.59 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 169.68 -179.73 41.94 Favored Glycine 0 N--CA 1.467 0.706 0 N-CA-C 115.241 0.856 . . . . 0.0 115.241 179.738 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -139.47 -57.23 0.58 Allowed 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.129 1.772 . . . . 0.0 110.824 -178.068 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 16.0 mtm -103.73 142.01 35.1 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 127.988 2.515 . . . . 0.0 111.257 173.165 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -154.79 144.99 21.9 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.292 1.037 . . . . 0.0 112.662 -176.138 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 43.7 p -76.12 172.04 13.48 Favored 'General case' 0 N--CA 1.484 1.263 0 O-C-N 121.121 -0.987 . . . . 0.0 111.094 168.334 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -56.76 -40.95 73.81 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.258 0 O-C-N 120.718 -1.239 . . . . 0.0 110.683 168.754 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -68.24 -40.76 81.91 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.429 1.092 . . . . 0.0 112.61 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 59.7 mt-10 -66.65 -40.99 88.93 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.591 0.756 . . . . 0.0 111.551 175.771 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 52.9 t -61.37 -48.58 88.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 O-C-N 121.785 -0.572 . . . . 0.0 110.841 171.525 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.43 -38.12 89.93 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 125.91 1.684 . . . . 0.0 113.955 -176.402 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 85.3 t60 -53.24 -51.6 61.65 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.297 0.639 . . . . 0.0 111.623 171.077 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -74.56 -32.48 62.43 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 176.785 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -71.85 -39.25 69.84 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.674 1.124 . . . . 0.0 112.564 178.861 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -60.4 -41.11 98.4 Favored Glycine 0 CA--C 1.536 1.393 0 CA-C-N 119.358 0.981 . . . . 0.0 111.732 171.724 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.6 tp60 -60.24 -51.37 69.86 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.479 1.512 . . . . 0.0 111.913 170.555 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.492 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 55.6 t80 -58.93 -49.99 75.73 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.0 -1.062 . . . . 0.0 110.397 179.766 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 56.7 mt -62.29 -36.51 74.94 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 124.896 1.278 . . . . 0.0 111.373 179.298 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 5.8 tpt -64.58 -40.08 94.89 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 119.6 1.091 . . . . 0.0 112.26 172.646 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 96.6 t -78.31 -34.08 18.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 124.293 1.037 . . . . 0.0 112.971 -179.052 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 47.4 mmtt -89.11 -15.68 33.31 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.89 1.276 . . . . 0.0 113.06 178.439 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 14.8 mp0 49.06 69.11 0.61 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.409 2.284 . . . . 0.0 112.601 -171.204 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 9.8 tp -90.74 -1.49 57.85 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.119 0.968 . . . . 0.0 112.776 -176.369 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -102.09 158.64 16.02 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.861 2.064 . . . . 0.0 111.184 175.403 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -88.47 127.69 35.52 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 169.117 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.26 -33.21 52.14 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.882 1.068 . . . . 0.0 113.882 179.553 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -90.38 -16.28 29.42 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.577 1.151 . . . . 0.0 112.466 -173.388 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -143.1 64.56 1.35 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 128.059 2.544 . . . . 0.0 109.432 -177.071 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -60.06 -21.82 61.92 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 121.241 -0.912 . . . . 0.0 113.053 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 5.6 p-80 -65.87 -6.55 12.55 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.31 1.444 . . . . 0.0 114.18 169.572 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 7.2 tpp -117.55 132.12 56.58 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 127.376 2.27 . . . . 0.0 110.379 174.592 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 11.7 t -115.4 123.28 70.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 126.017 1.727 . . . . 0.0 108.298 175.28 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 81.0 t80 -109.14 103.68 12.72 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.21 1.004 . . . . 0.0 109.913 -178.068 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 73.0 m -95.67 15.11 20.89 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -175.047 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.54 118.8 14.8 Favored Glycine 0 CA--C 1.535 1.334 0 O-C-N 121.468 -0.77 . . . . 0.0 112.093 179.584 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 76.96 5.62 84.86 Favored Glycine 0 CA--C 1.541 1.717 0 C-N-CA 124.485 1.04 . . . . 0.0 115.512 -175.544 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -93.79 158.66 15.55 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.189 1.494 . . . . 0.0 112.044 174.51 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 64.6 mt -48.96 -35.38 15.01 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.811 1.244 . . . . 0.0 113.286 177.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -58.88 -45.37 90.38 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.595 0.758 . . . . 0.0 111.743 175.037 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -74.7 -33.93 54.59 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 125.407 1.48 . . . . 0.0 113.902 176.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -59.32 -46.55 88.3 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-N 120.748 2.274 . . . . 0.0 110.096 171.631 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 32.0 tp -68.88 -51.63 38.16 Favored 'General case' 0 CA--C 1.552 1.054 0 CA-C-N 114.303 -1.317 . . . . 0.0 113.178 -176.782 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -89.55 -8.34 52.95 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 124.312 1.045 . . . . 0.0 112.608 -177.224 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 83.98 -27.04 4.56 Favored Glycine 0 CA--C 1.541 1.657 0 O-C-N 119.866 -1.771 . . . . 0.0 112.714 -169.566 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.12 140.31 4.39 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 128.55 2.74 . . . . 0.0 110.655 178.288 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -142.76 35.98 1.43 Allowed 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.795 0.838 . . . . 0.0 110.931 169.411 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 5.1 m -86.86 125.01 33.7 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 120.712 -1.242 . . . . 0.0 109.663 169.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -163.6 169.18 18.99 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.176 1.391 . . . . 0.0 111.859 -169.32 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 13.0 m -115.65 136.14 53.36 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.045 -0.98 . . . . 0.0 111.536 176.173 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -77.76 -14.35 14.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 124.483 1.113 . . . . 0.0 113.519 -169.205 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.2 pttt -75.26 -8.36 56.41 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.478 1.511 . . . . 0.0 114.651 169.851 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -117.99 83.88 20.05 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 126.394 1.878 . . . . 0.0 110.522 -175.31 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -67.08 -31.44 36.75 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 123.725 2.95 . . . . 0.0 114.855 -171.677 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 54.5 m -58.32 -51.97 77.96 Favored Pre-proline 0 N--CA 1.476 0.85 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -176.066 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -67.28 -33.98 28.82 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 121.88 1.72 . . . . 0.0 112.58 174.843 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 8.2 tp -60.38 -46.48 89.82 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.867 1.267 . . . . 0.0 110.878 176.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -56.97 -38.27 72.75 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.294 0.952 . . . . 0.0 112.52 177.257 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -64.76 -51.46 62.17 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.584 1.084 . . . . 0.0 112.379 177.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -68.52 -29.52 68.13 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 114.06 1.133 . . . . 0.0 114.06 177.538 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 39.7 tp -75.58 -53.54 8.45 Favored 'General case' 0 C--O 1.224 -0.255 0 C-N-CA 126.506 1.922 . . . . 0.0 110.972 178.777 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 49.9 mtp180 -59.48 -27.39 66.08 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-N 119.42 1.009 . . . . 0.0 113.474 -176.664 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -75.97 -26.4 56.76 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.297 1.439 . . . . 0.0 113.691 173.811 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 34.5 m-20 -104.75 -21.54 13.35 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 179.59 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 21.0 tp -137.05 110.16 7.76 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 127.916 2.487 . . . . 0.0 107.337 171.428 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 15.0 p -66.2 115.5 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-O 121.324 0.583 . . . . 0.0 110.495 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 7.7 t -161.84 -179.17 6.99 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.31 1.444 . . . . 0.0 111.203 -174.159 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -72.15 175.92 5.6 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.709 1.604 . . . . 0.0 114.348 176.749 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -125.56 164.07 21.35 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.295 1.838 . . . . 0.0 112.924 -171.372 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 66.4 p . . . . . 0 N--CA 1.483 1.182 0 C-N-CA 126.707 2.003 . . . . 0.0 113.966 174.167 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 200' ' ' 44Z . . . . . 0.432 ' CD3' ' CG1' ' A' ' 200' ' ' 44Z . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 . . . . . 0 CA--C 1.544 0.712 0 CA-C-O 121.14 0.495 . . . . 0.0 112.281 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.4 pp -71.8 160.75 5.1 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 C-N-CA 125.94 1.696 . . . . 0.0 113.266 177.093 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -81.47 -11.53 59.19 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -178.604 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 8.2 mm100 -68.4 162.2 25.91 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.831 2.052 . . . . 0.0 114.036 178.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.1 m -132.07 172.11 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 C-N-CA 125.808 1.643 . . . . 0.0 113.332 -169.148 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.403 ' HG2' ' HB3' ' A' ' 46' ' ' MET . 43.4 mtm180 -69.54 146.89 96.5 Favored Pre-proline 0 N--CA 1.486 1.371 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -169.567 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo -88.9 -177.14 1.56 Allowed 'Trans proline' 0 C--N 1.354 0.823 1 C-N-CA 125.392 4.061 . . . . 0.0 113.447 -176.304 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.0 ttmt -68.03 147.85 51.81 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.745 0.818 . . . . 0.0 109.128 169.182 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 92.4 mt -60.2 -42.07 87.67 Favored Pre-proline 0 N--CA 1.478 0.929 0 N-CA-C 115.354 1.612 . . . . 0.0 115.354 -168.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -59.58 -31.4 94.41 Favored 'Trans proline' 0 CA--C 1.537 0.631 0 CA-C-N 121.76 1.664 . . . . 0.0 114.032 176.35 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.1 tt -64.4 -44.77 90.22 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.071 0.851 . . . . 0.0 110.536 175.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 49.7 tp -61.11 -39.04 88.5 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.229 0.612 . . . . 0.0 111.797 175.138 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -67.21 -36.62 82.1 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 175.256 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 87.5 mt -63.89 -42.55 96.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 123.828 0.851 . . . . 0.0 111.346 171.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 97.7 mt -63.65 -37.2 86.45 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.154 -0.966 . . . . 0.0 112.661 173.143 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 65.2 m170 -61.76 -44.66 96.46 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 118.813 0.733 . . . . 0.0 111.581 169.804 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.76 -28.72 69.77 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.184 0.994 . . . . 0.0 112.976 177.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.438 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -73.99 -3.81 31.49 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.456 1.102 . . . . 0.0 113.552 172.445 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.81 12.32 60.74 Favored Glycine 0 CA--C 1.536 1.375 0 C-N-CA 125.177 1.37 . . . . 0.0 115.355 177.17 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -106.93 156.39 18.76 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.011 1.325 . . . . 0.0 112.736 -179.714 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -80.62 -178.48 6.76 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.684 -0.635 . . . . 0.0 111.07 169.071 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 176.79 155.01 12.56 Favored Glycine 0 C--N 1.34 0.781 0 N-CA-C 118.497 2.159 . . . . 0.0 118.497 176.772 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -147.01 -67.71 0.26 Allowed 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 127.227 2.211 . . . . 0.0 108.078 169.18 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.403 ' HB3' ' HG2' ' A' ' 28' ' ' ARG . 1.5 pmm? -130.09 154.63 47.27 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 126.214 1.806 . . . . 0.0 115.548 176.388 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -154.57 160.81 41.72 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 115.183 1.549 . . . . 0.0 115.183 -168.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 44.6 p -96.42 173.26 7.46 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 127.028 2.131 . . . . 0.0 109.893 167.712 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.2 t -56.54 -41.94 74.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 CA-C-N 120.785 1.629 . . . . 0.0 110.001 169.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 56.8 tptt -60.27 -43.17 96.43 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.729 1.15 . . . . 0.0 112.386 -179.671 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -74.12 -36.89 64.23 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 83.3 t -67.85 -50.57 58.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 CA-C-N 118.959 0.799 . . . . 0.0 111.013 172.48 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.6 ppp? -69.54 -26.52 64.54 Favored 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 114.55 1.315 . . . . 0.0 114.55 -168.572 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -57.77 -54.24 49.08 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.289 0.636 . . . . 0.0 110.826 171.121 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -74.54 -31.08 62.01 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 176.379 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -69.43 -39.1 78.06 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 120.61 1.55 . . . . 0.0 112.627 175.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.6 -47.36 89.81 Favored Glycine 0 CA--C 1.53 1.011 0 CA-C-N 118.986 0.812 . . . . 0.0 111.466 172.051 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.0 tp60 -57.62 -43.22 84.61 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.313 1.045 . . . . 0.0 112.356 172.503 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.438 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 59.4 t80 -62.79 -53.8 48.8 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.28 1.432 . . . . 0.0 110.621 177.962 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 34.7 mt -57.04 -37.36 54.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 124.288 1.035 . . . . 0.0 110.751 177.152 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 40.3 mmm -70.23 -41.47 73.55 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 114.141 1.163 . . . . 0.0 114.141 176.191 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.8 p -78.48 -26.31 13.92 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 CA-C-N 119.974 1.261 . . . . 0.0 112.99 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 55.5 mmtt -91.77 -14.44 29.87 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.817 1.647 . . . . 0.0 113.253 173.792 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.8 mp0 52.19 62.3 2.77 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 126.766 2.026 . . . . 0.0 113.673 -176.182 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 45.8 mt -88.37 -5.24 58.42 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 121.576 -0.703 . . . . 0.0 112.749 174.693 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 46.3 p90 -84.62 157.19 21.25 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.986 1.314 . . . . 0.0 111.703 172.573 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -87.41 126.83 35.11 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 169.454 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.46 -30.74 61.11 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 179.084 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -94.73 -21.08 18.98 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.712 1.205 . . . . 0.0 112.809 -170.74 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -140.07 68.44 1.36 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 127.765 2.426 . . . . 0.0 109.056 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -63.35 -16.96 61.99 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 114.05 1.13 . . . . 0.0 114.05 -169.845 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 32.8 p80 -61.53 -29.89 70.29 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 118.706 -0.664 . . . . 0.0 112.689 169.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 17.9 mtp -87.99 145.5 25.97 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 113.62 0.971 . . . . 0.0 113.62 176.186 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 t -131.0 131.21 64.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 C-N-CA 126.073 1.749 . . . . 0.0 108.743 173.825 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -112.66 103.57 11.61 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.553 1.541 . . . . 0.0 108.758 174.571 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 15.0 m -103.05 9.69 38.42 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.73 0.812 . . . . 0.0 112.402 176.008 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.75 -27.32 66.35 Favored Glycine 0 CA--C 1.537 1.444 0 C-N-CA 124.999 1.285 . . . . 0.0 114.795 -174.336 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -88.24 2.09 84.94 Favored Glycine 0 CA--C 1.54 1.631 0 C-N-CA 124.988 1.28 . . . . 0.0 115.202 173.789 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -110.67 177.78 4.57 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.471 1.508 . . . . 0.0 112.727 -175.061 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 80.4 mt -51.73 -35.84 44.79 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.205 1.402 . . . . 0.0 113.201 171.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 94.5 mt -61.2 -47.91 83.97 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 121.624 -0.673 . . . . 0.0 110.933 174.643 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -67.8 -34.79 83.76 Favored Glycine 0 CA--C 1.532 1.142 0 CA-C-O 119.032 -0.871 . . . . 0.0 113.464 176.709 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.42 -28.77 63.18 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 119.43 1.615 . . . . 0.0 112.449 176.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 40.8 tp -74.42 -53.61 9.23 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.875 1.27 . . . . 0.0 112.416 173.366 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -96.82 -17.24 20.34 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.787 1.403 . . . . 0.0 114.787 -169.442 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 80.85 -17.96 10.21 Favored Glycine 0 CA--C 1.539 1.584 0 C-N-CA 125.66 1.6 . . . . 0.0 116.061 -177.85 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.04 31.13 0.62 Allowed 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 116.362 1.986 . . . . 0.0 116.362 -174.23 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 8.0 mm-40 -69.35 73.17 0.33 Allowed 'General case' 0 N--CA 1.477 0.886 0 O-C-N 121.336 -0.852 . . . . 0.0 112.853 -179.208 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 12.1 m -134.38 136.43 43.36 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.083 1.353 . . . . 0.0 109.178 169.147 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 54.5 p90 -160.08 174.06 14.88 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -168.545 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.8 t -124.59 141.42 52.11 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 124.852 1.261 . . . . 0.0 110.548 169.019 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.548 HG21 ' CD5' ' A' ' 200' ' ' 44Z . 25.9 m -72.0 -12.28 15.73 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 175.21 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 41.4 pttt -77.35 -10.71 59.61 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 113.683 0.994 . . . . 0.0 113.683 172.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -123.48 77.42 54.54 Favored Pre-proline 0 CA--C 1.548 0.866 0 C-N-CA 126.285 1.834 . . . . 0.0 109.642 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -68.83 -28.05 30.44 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 123.389 2.726 . . . . 0.0 114.873 -169.355 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 62.5 m -59.4 -55.14 49.05 Favored Pre-proline 0 N--CA 1.476 0.863 0 CA-C-N 120.172 1.351 . . . . 0.0 114.436 -177.444 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -65.88 -29.74 49.65 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 122.11 1.873 . . . . 0.0 112.93 176.438 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 26.5 tp -66.37 -46.48 76.55 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.89 0.876 . . . . 0.0 110.746 174.836 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -61.83 -39.25 91.14 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 118.557 -0.735 . . . . 0.0 112.638 172.253 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -59.36 -48.9 79.88 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 119.778 1.172 . . . . 0.0 112.599 177.442 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 41.3 mtm -62.31 -47.91 82.2 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.653 0.781 . . . . 0.0 112.634 173.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 61.7 mt -56.65 -45.26 81.73 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 124.312 1.045 . . . . 0.0 110.978 177.373 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 24.0 ttt180 -60.42 -21.64 62.47 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 120.052 1.296 . . . . 0.0 114.234 175.147 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -86.85 -17.5 33.21 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.5 1.52 . . . . 0.0 113.208 172.727 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 53.9 t30 -104.92 -25.19 12.69 Favored 'General case' 0 CA--C 1.555 1.138 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 176.547 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 55.1 tp -131.21 133.04 45.11 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 128.739 2.816 . . . . 0.0 108.548 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 62.6 t -73.0 106.88 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 171.645 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 10.0 t -158.8 -172.83 3.97 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 125.045 1.338 . . . . 0.0 111.776 -174.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 3.0 pp -73.76 177.93 5.16 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.811 2.045 . . . . 0.0 114.41 176.698 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -124.14 167.66 13.95 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.2 1.8 . . . . 0.0 112.9 -172.441 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 8.8 t . . . . . 0 N--CA 1.48 1.029 0 C-N-CA 123.871 0.869 . . . . 0.0 113.284 175.473 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 200' ' ' 44Z . . . . . 0.548 ' CD5' HG21 ' A' ' 92' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 21.7 pt20 . . . . . 0 CA--C 1.544 0.723 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.0 mt -107.45 143.66 17.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 C-N-CA 125.658 1.583 . . . . 0.0 109.38 178.433 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 45.9 t30 -83.95 87.76 7.12 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.057 0.943 . . . . 0.0 110.436 173.188 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -88.53 -179.65 6.1 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 114.271 1.212 . . . . 0.0 114.271 -171.399 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 23.4 m -114.62 168.35 6.52 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 127.203 2.201 . . . . 0.0 109.675 169.013 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.7 ttp-105 -101.39 129.85 26.04 Favored Pre-proline 0 N--CA 1.481 1.099 0 O-C-N 120.876 -1.14 . . . . 0.0 111.408 178.281 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -75.24 -177.03 3.22 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.736 2.958 . . . . 0.0 112.121 173.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.5 ttmt -64.06 148.09 50.6 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 121.394 -0.816 . . . . 0.0 110.668 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.9 mt -55.84 -45.85 99.83 Favored Pre-proline 0 N--CA 1.476 0.836 0 N-CA-C 115.225 1.565 . . . . 0.0 115.225 -168.361 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -64.8 -24.17 61.8 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 CA-C-N 122.219 1.828 . . . . 0.0 113.773 175.096 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 tp -66.68 -40.26 88.49 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.774 1.17 . . . . 0.0 110.919 172.194 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.9 tt -63.37 -37.91 89.09 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.824 0.85 . . . . 0.0 111.41 171.3 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.433 ' HA ' ' HE2' ' A' ' 35' ' ' LYS . 11.1 mmpt? -60.99 -43.21 99.2 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 121.516 -0.74 . . . . 0.0 112.565 171.242 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 83.3 mt -62.75 -42.38 96.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.994 0.918 . . . . 0.0 111.5 174.542 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 55.8 mt -63.57 -38.61 91.79 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.473 -0.767 . . . . 0.0 111.671 176.735 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 17.6 m170 -67.67 -41.05 84.32 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.584 -0.697 . . . . 0.0 111.789 172.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.37 -26.83 68.93 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.182 0.993 . . . . 0.0 113.292 174.043 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.435 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -71.25 -6.78 42.31 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.154 0.982 . . . . 0.0 113.462 171.833 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 94.75 7.19 60.24 Favored Glycine 0 CA--C 1.536 1.397 0 C-N-CA 125.638 1.59 . . . . 0.0 115.063 -178.535 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -89.09 170.64 10.46 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 118.931 1.365 . . . . 0.0 112.874 178.189 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 34.4 tp60 -128.14 139.03 52.72 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.607 1.563 . . . . 0.0 109.013 169.378 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 175.94 150.8 8.28 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 115.275 0.87 . . . . 0.0 115.275 -179.534 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -125.06 13.39 8.4 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 127.023 2.129 . . . . 0.0 111.641 172.398 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.2 mtm -174.9 134.44 0.35 Allowed 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 128.916 2.886 . . . . 0.0 109.343 -172.146 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -154.08 143.88 21.78 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.192 0.997 . . . . 0.0 113.145 -174.588 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 51.4 p -85.75 170.06 12.82 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 121.058 -1.026 . . . . 0.0 111.203 168.657 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 2.7 t -55.81 -43.92 75.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 O-C-N 120.337 -1.477 . . . . 0.0 110.391 169.378 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -57.29 -34.69 68.94 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 120.813 -1.179 . . . . 0.0 113.002 177.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -80.43 -45.79 17.04 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 113.183 0.808 . . . . 0.0 113.183 173.618 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 79.5 t -61.61 -49.1 85.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 123.482 0.713 . . . . 0.0 110.895 -177.711 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.71 -38.58 83.81 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 123.375 0.67 . . . . 0.0 111.944 -172.895 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -56.46 -52.45 64.65 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.423 176.558 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 45.9 m-85 -74.41 -29.93 61.71 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 176.782 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.4 mp -68.28 -37.91 81.18 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 120.793 1.633 . . . . 0.0 112.215 171.687 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -61.95 -43.41 99.22 Favored Glycine 0 CA--C 1.531 1.069 0 CA-C-N 119.13 0.877 . . . . 0.0 111.828 171.549 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.2 tp60 -60.89 -43.09 98.96 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.394 1.077 . . . . 0.0 112.446 171.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.435 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 49.4 t80 -61.35 -51.78 67.37 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.205 1.002 . . . . 0.0 110.58 175.44 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 69.1 mt -59.8 -38.56 76.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 124.54 1.136 . . . . 0.0 110.825 179.095 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.2 tpt -63.63 -47.63 80.56 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.985 1.314 . . . . 0.0 112.509 174.127 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.2 p -78.63 -28.46 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 -175.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 57.5 mmtt -91.97 -15.78 27.48 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.459 1.503 . . . . 0.0 113.522 174.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.4 mp0 55.06 63.6 2.07 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.947 2.099 . . . . 0.0 112.992 -174.07 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 11.2 tp -88.29 -9.37 53.06 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.003 0.921 . . . . 0.0 112.3 176.739 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 26.4 p90 -88.58 162.08 16.57 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.134 1.774 . . . . 0.0 110.874 169.857 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -99.9 129.67 46.01 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 122.029 -0.42 . . . . 0.0 110.72 169.629 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.2 -20.57 59.29 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 113.934 1.087 . . . . 0.0 113.934 173.847 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -82.94 -31.44 27.7 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.639 1.176 . . . . 0.0 111.347 -178.648 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -152.33 69.99 0.9 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.262 1.825 . . . . 0.0 111.957 -169.885 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 27.9 mp0 -56.36 -20.8 20.91 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.233 1.413 . . . . 0.0 113.795 -178.709 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 30.5 p80 -65.32 -12.82 55.67 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 174.067 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 22.5 tpp -111.61 135.97 51.46 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 126.621 1.968 . . . . 0.0 111.105 172.211 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 18.9 t -119.7 107.89 22.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 125.713 1.605 . . . . 0.0 108.309 171.689 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -92.15 110.98 22.37 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.223 0.609 . . . . 0.0 110.672 -177.143 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 84.3 m -103.58 14.84 30.35 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 -170.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.47 120.74 23.6 Favored Glycine 0 CA--C 1.535 1.303 0 O-C-N 121.411 -0.805 . . . . 0.0 111.711 176.235 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 80.0 0.59 85.93 Favored Glycine 0 CA--C 1.54 1.625 0 C-N-CA 124.533 1.063 . . . . 0.0 115.575 -174.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -80.39 158.07 26.11 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.42 1.61 . . . . 0.0 111.496 171.191 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 10.9 mp -46.69 -41.16 14.51 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.312 1.445 . . . . 0.0 112.336 169.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 98.6 mt -57.52 -43.39 84.26 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.028 0.931 . . . . 0.0 111.703 174.799 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -72.64 -36.74 58.26 Favored Glycine 0 CA--C 1.53 0.981 0 CA-C-O 118.499 -1.167 . . . . 0.0 113.42 178.812 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -62.56 -42.55 99.61 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 120.318 2.059 . . . . 0.0 110.425 173.05 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 30.9 tp -65.34 -50.44 65.62 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.314 1.046 . . . . 0.0 113.191 -179.139 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -95.06 -7.64 38.98 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 124.782 1.233 . . . . 0.0 112.611 -175.363 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 82.47 -28.05 3.54 Favored Glycine 0 CA--C 1.541 1.662 0 C-N-CA 125.795 1.664 . . . . 0.0 113.167 -169.894 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.48 136.51 6.4 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 129.01 2.924 . . . . 0.0 109.265 176.544 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -139.32 22.96 2.55 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 119.267 0.939 . . . . 0.0 112.218 177.512 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 14.7 m -84.78 129.59 34.8 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 179.46 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 5.1 p90 -159.29 171.26 20.15 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.854 -1.066 . . . . 0.0 112.251 -168.695 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 79.9 p -113.39 136.26 52.96 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 114.659 -1.155 . . . . 0.0 113.434 177.122 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 3.7 m -77.65 -9.86 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 N-CA-C 114.066 1.136 . . . . 0.0 114.066 -177.243 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -80.91 -8.73 59.81 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.859 1.664 . . . . 0.0 115.149 174.227 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 39.0 t0 -131.29 90.11 39.24 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 125.519 1.527 . . . . 0.0 111.197 -172.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -67.46 -27.39 39.76 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 123.595 2.863 . . . . 0.0 115.08 -174.487 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 66.0 m -61.11 -53.16 66.21 Favored Pre-proline 0 N--CA 1.476 0.872 0 N-CA-C 114.326 1.232 . . . . 0.0 114.326 -177.562 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -66.6 -31.64 40.5 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 122.364 2.043 . . . . 0.0 112.761 175.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 6.5 tp -60.98 -49.02 79.12 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.779 1.232 . . . . 0.0 111.093 173.643 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -59.03 -29.26 67.15 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 -176.413 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -68.78 -51.52 40.14 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.604 1.093 . . . . 0.0 111.822 177.877 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 3.4 ptt? -68.86 -29.52 67.84 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.021 0.928 . . . . 0.0 112.633 178.116 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 17.7 tp -76.15 -47.13 25.44 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 126.821 2.049 . . . . 0.0 111.44 179.409 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 74.5 mtt180 -57.34 -27.47 62.27 Favored 'General case' 0 N--CA 1.485 1.282 0 CA-C-N 120.379 1.445 . . . . 0.0 113.16 176.08 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 90.4 mttt -76.49 -24.02 53.79 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.511 1.525 . . . . 0.0 113.509 174.738 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 60.2 m-20 -112.64 -22.23 10.86 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -177.904 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.6 tt -136.58 125.17 23.68 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 127.701 2.4 . . . . 0.0 108.265 -173.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 59.8 t -69.39 110.46 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 O-C-N 121.589 -0.694 . . . . 0.0 110.045 -179.394 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 12.4 t -148.91 165.62 31.02 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.964 1.706 . . . . 0.0 110.794 178.261 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.629 ' H ' HD13 ' A' ' 109' ' ' LEU . 0.0 OUTLIER -75.02 165.29 25.49 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 114.969 1.47 . . . . 0.0 114.969 -173.019 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -129.64 16.55 5.88 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 126.331 1.853 . . . . 0.0 114.59 -169.057 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 8.4 t . . . . . 0 N--CA 1.478 0.966 0 C-N-CA 125.585 1.554 . . . . 0.0 112.842 -176.552 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 200' ' ' 44Z . . . . . 0.422 ' CD3' ' CG1' ' A' ' 200' ' ' 44Z . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 . . . . . 0 CA--C 1.54 0.577 0 CA-C-O 121.914 0.864 . . . . 0.0 112.302 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 34.5 pt -94.95 1.04 10.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 C-N-CA 126.966 2.106 . . . . 0.0 115.519 -169.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 60.8 t30 55.39 13.88 1.0 Allowed 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 127.178 2.191 . . . . 0.0 115.39 -176.432 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.9 mm100 -112.98 167.74 10.27 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.704 2.001 . . . . 0.0 113.726 -172.41 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 24.1 m -134.53 172.5 16.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.984 0 C-N-CA 127.843 2.457 . . . . 0.0 110.869 -170.216 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 -79.7 144.55 60.72 Favored Pre-proline 0 N--CA 1.483 1.201 0 O-C-N 121.125 -0.984 . . . . 0.0 110.934 -172.525 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -73.12 176.71 8.75 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 123.542 2.828 . . . . 0.0 112.291 176.588 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -58.22 146.81 32.52 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.873 0.869 . . . . 0.0 110.054 173.892 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.1 mp -56.5 -46.41 99.82 Favored Pre-proline 0 N--CA 1.476 0.864 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -169.312 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -66.75 -25.27 46.4 Favored 'Trans proline' 0 C--N 1.351 0.687 0 CA-C-N 121.513 1.576 . . . . 0.0 113.706 176.007 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.1 tt -69.73 -40.84 75.97 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.235 0.925 . . . . 0.0 109.972 173.334 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 28.6 tp -59.6 -36.92 77.24 Favored 'General case' 0 CA--C 1.547 0.846 0 O-C-N 120.954 -1.091 . . . . 0.0 111.421 169.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 19.7 mmtp -67.1 -33.72 76.08 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 173.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 83.4 mt -62.29 -38.99 82.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 124.439 1.096 . . . . 0.0 111.728 170.687 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.7 mp -68.95 -37.22 78.73 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 120.076 1.307 . . . . 0.0 112.356 171.257 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 58.7 m170 -60.87 -43.55 98.26 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 119.22 0.918 . . . . 0.0 111.697 172.176 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.66 -23.44 67.26 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.939 1.296 . . . . 0.0 113.416 175.881 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.468 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -72.08 -6.7 44.33 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 123.711 0.804 . . . . 0.0 113.089 171.624 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.73 19.38 40.82 Favored Glycine 0 CA--C 1.536 1.351 0 C-N-CA 125.142 1.353 . . . . 0.0 114.712 178.819 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -126.24 145.27 50.47 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.868 1.267 . . . . 0.0 113.133 -175.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -74.5 153.6 39.05 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.915 0.886 . . . . 0.0 110.177 169.762 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -150.76 134.92 4.94 Favored Glycine 0 CA--C 1.529 0.922 0 N-CA-C 115.601 1.0 . . . . 0.0 115.601 179.479 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -148.88 78.57 1.4 Allowed 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 127.168 2.187 . . . . 0.0 108.847 173.592 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . 0.435 0.0 OUTLIER 64.87 141.01 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 129.536 3.134 . . . . 0.0 117.838 176.072 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -161.8 171.56 17.6 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 114.055 1.131 . . . . 0.0 114.055 -168.735 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 37.7 p -96.47 174.23 6.96 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 127.109 2.163 . . . . 0.0 112.523 169.804 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 15.9 t -50.19 -46.12 24.6 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 O-C-N 121.173 -0.954 . . . . 0.0 111.545 171.389 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -57.37 -38.51 74.33 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.752 0.821 . . . . 0.0 112.639 -176.667 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -80.51 -34.95 35.26 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.42 1.088 . . . . 0.0 112.948 176.612 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 73.2 t -72.79 -45.88 55.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 O-C-N 121.215 -0.928 . . . . 0.0 112.291 -179.759 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.419 ' SD ' ' CD2' ' A' ' 200' ' ' 44Z . 22.3 mmt -64.59 -30.66 71.68 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-N 120.012 1.278 . . . . 0.0 112.643 -178.303 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 85.4 t60 -53.85 -53.75 48.18 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.431 173.7 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -74.61 -34.27 62.79 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 174.777 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -70.29 -43.72 69.82 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.775 1.17 . . . . 0.0 112.814 -179.411 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.98 -39.68 98.37 Favored Glycine 0 CA--C 1.531 1.084 0 CA-C-N 118.843 0.747 . . . . 0.0 111.873 173.839 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.2 tp60 -61.18 -48.09 83.16 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.667 1.187 . . . . 0.0 111.934 172.146 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.468 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 66.3 t80 -60.7 -50.07 74.95 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.811 0.844 . . . . 0.0 110.885 177.29 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 60.4 mt -61.76 -35.76 69.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 124.817 1.247 . . . . 0.0 111.26 179.006 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.2 tpt -65.53 -39.52 91.87 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.595 1.158 . . . . 0.0 112.514 171.546 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 84.3 t -78.32 -32.97 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 CA-C-N 119.336 0.971 . . . . 0.0 112.969 -179.065 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 47.8 mmtt -90.46 -15.53 30.68 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.021 1.329 . . . . 0.0 113.15 177.925 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.3 mp0 50.17 66.45 1.14 Allowed 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 127.295 2.238 . . . . 0.0 113.183 -173.314 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 51.5 mt -91.2 0.64 57.49 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.52 0.728 . . . . 0.0 112.901 177.541 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 54.4 p90 -89.3 157.49 18.18 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.945 1.298 . . . . 0.0 111.354 171.268 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -88.52 134.58 33.82 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 121.86 -0.525 . . . . 0.0 110.69 169.69 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.47 -21.34 65.39 Favored 'General case' 0 CA--C 1.544 0.727 0 O-C-N 120.893 -1.129 . . . . 0.0 113.689 172.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -82.69 -34.57 27.32 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.704 1.202 . . . . 0.0 111.101 -179.41 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -147.89 76.35 1.38 Allowed 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 128.035 2.534 . . . . 0.0 109.43 -169.66 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 26.3 mp0 -59.34 -23.56 62.61 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.299 -0.876 . . . . 0.0 113.003 -178.232 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 3.3 p-80 -66.12 -23.22 66.45 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 171.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 12.6 tpp -87.06 132.05 33.93 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.758 1.223 . . . . 0.0 110.092 170.587 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.7 t -124.41 112.09 30.99 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 C-N-CA 126.577 1.951 . . . . 0.0 108.968 -175.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 58.0 t80 -89.98 59.26 4.47 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.411 1.485 . . . . 0.0 111.468 -176.333 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 52.5 m -72.28 -4.51 30.06 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 120.832 -1.168 . . . . 0.0 113.021 171.651 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.3 -24.65 59.27 Favored Glycine 0 CA--C 1.541 1.682 0 CA-C-N 120.648 1.567 . . . . 0.0 113.819 169.725 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -91.1 6.54 81.5 Favored Glycine 0 CA--C 1.542 1.778 0 C-N-CA 125.528 1.537 . . . . 0.0 115.326 171.688 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -112.13 171.1 7.71 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.249 1.82 . . . . 0.0 112.494 -173.729 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.1 mp -47.16 -40.23 15.37 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.244 1.418 . . . . 0.0 111.969 169.257 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.1 tp -64.76 -32.22 73.81 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.879 0.872 . . . . 0.0 111.945 175.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -75.11 -35.09 50.38 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 126.515 2.007 . . . . 0.0 114.458 174.331 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -65.63 -42.62 91.29 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 119.791 1.796 . . . . 0.0 110.232 169.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 25.6 tp -60.59 -49.33 77.96 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.155 1.382 . . . . 0.0 112.588 179.29 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.34 -11.09 21.52 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 115.478 1.658 . . . . 0.0 115.478 -177.937 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.11 -18.81 8.95 Favored Glycine 0 CA--C 1.539 1.59 0 C-N-CA 125.843 1.687 . . . . 0.0 115.968 179.626 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.33 28.64 0.57 Allowed 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 115.018 1.488 . . . . 0.0 115.018 -175.617 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -70.66 46.34 0.09 Allowed 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 116.212 1.93 . . . . 0.0 116.212 -168.21 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 41.0 m -105.93 142.41 35.68 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 120.789 -1.194 . . . . 0.0 110.491 170.155 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -161.39 171.4 18.31 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 -168.126 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 3.5 m -121.92 136.26 54.92 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.247 1.019 . . . . 0.0 111.389 174.689 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.476 HG21 ' CE5' ' A' ' 200' ' ' 44Z . 22.4 m -74.22 -21.65 17.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 C-N-CA 124.214 1.005 . . . . 0.0 113.707 -175.239 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -72.72 -8.58 56.06 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 125.335 1.454 . . . . 0.0 114.375 174.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 47.0 t0 -117.64 82.78 16.47 Favored Pre-proline 0 CA--C 1.547 0.851 0 C-N-CA 126.786 2.034 . . . . 0.0 109.097 -179.521 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -66.57 -31.9 40.25 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 123.478 2.785 . . . . 0.0 114.591 -169.818 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 55.7 m -56.7 -54.19 56.53 Favored Pre-proline 0 N--CA 1.476 0.856 0 CA-C-N 120.057 1.299 . . . . 0.0 113.949 -176.816 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -66.2 -28.52 47.98 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 122.071 1.847 . . . . 0.0 113.209 175.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 32.4 tp -69.61 -43.47 72.68 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.145 -0.972 . . . . 0.0 111.255 176.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -65.92 -34.3 77.8 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 121.496 -0.753 . . . . 0.0 112.329 171.42 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -63.08 -46.74 86.01 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.348 0.976 . . . . 0.0 112.578 175.006 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.488 ' HE3' ' HB2' ' A' ' 101' ' ' MET . 47.7 mtm -60.2 -49.92 75.73 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.244 0.618 . . . . 0.0 111.656 170.87 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 49.6 mt -59.92 -45.52 92.31 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-O 118.023 -0.989 . . . . 0.0 111.648 -176.876 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -55.09 -25.81 33.8 Favored 'General case' 0 N--CA 1.48 1.038 0 CA-C-N 119.926 1.239 . . . . 0.0 114.139 175.745 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -94.22 -16.77 23.34 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 125.322 1.449 . . . . 0.0 114.782 174.318 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 24.9 m-80 -117.95 -41.86 2.87 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-N 119.418 1.008 . . . . 0.0 113.598 -171.762 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 39.5 tp -102.78 95.94 6.52 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.614 1.966 . . . . 0.0 107.971 169.561 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 21.8 t -61.18 135.11 26.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-O 121.419 0.628 . . . . 0.0 110.941 -171.057 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 9.1 t -146.42 -172.73 4.02 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 126.358 1.863 . . . . 0.0 111.024 -170.391 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -83.06 25.83 0.66 Allowed 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.341 1.856 . . . . 0.0 114.385 -170.279 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -150.95 146.67 26.41 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.672 1.989 . . . . 0.0 111.268 -178.48 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 9.7 t . . . . . 0 N--CA 1.484 1.226 0 C-N-CA 126.897 2.079 . . . . 0.0 114.471 -176.829 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 200' ' ' 44Z . . . . . 0.476 ' CE5' HG21 ' A' ' 92' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 . . . . . 0 CA--C 1.544 0.739 0 CA-C-O 120.952 0.406 . . . . 0.0 111.703 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 34.4 mm -70.82 132.82 32.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 124.154 0.982 . . . . 0.0 111.073 178.312 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -131.0 17.38 5.09 Favored 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 126.398 1.879 . . . . 0.0 111.888 170.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -85.71 -179.41 6.85 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.858 2.063 . . . . 0.0 112.644 -178.187 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.1 m -103.68 172.05 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 126.302 1.841 . . . . 0.0 111.181 -178.646 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 42.8 ttp180 -110.42 134.98 20.68 Favored Pre-proline 0 N--CA 1.479 0.987 0 C-N-CA 124.195 0.998 . . . . 0.0 112.914 -169.757 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.01 159.2 54.08 Favored 'Trans proline' 0 CA--C 1.537 0.637 0 C-N-CA 122.367 2.044 . . . . 0.0 111.788 169.575 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -55.55 161.19 2.12 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 115.027 1.492 . . . . 0.0 115.027 177.623 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 22.2 mt -61.15 -41.72 82.26 Favored Pre-proline 0 CA--C 1.548 0.881 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 -168.672 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -70.08 -30.76 20.28 Favored 'Trans proline' 0 C--N 1.355 0.871 0 C-N-CA 122.152 1.901 . . . . 0.0 112.763 169.557 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 tt -71.95 -43.87 64.5 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.795 1.238 . . . . 0.0 110.841 -175.244 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 23.8 tp -53.65 -37.28 62.97 Favored 'General case' 0 CA--C 1.548 0.899 0 O-C-N 120.98 -1.075 . . . . 0.0 111.801 171.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -72.41 -19.18 61.64 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.198 0.999 . . . . 0.0 113.695 177.508 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 84.7 mt -69.49 -41.72 80.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 CA-C-N 118.988 0.813 . . . . 0.0 109.074 168.092 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.4 mp -66.73 -35.92 81.25 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 121.564 -0.71 . . . . 0.0 110.913 175.192 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 50.6 m170 -60.85 -49.51 77.17 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 118.362 0.528 . . . . 0.0 111.535 169.524 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.18 -23.85 67.62 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.525 1.13 . . . . 0.0 113.903 177.535 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.402 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -67.43 -14.83 63.28 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.402 1.081 . . . . 0.0 113.066 173.107 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.74 22.52 10.98 Favored Glycine 0 CA--C 1.537 1.415 0 C-N-CA 125.26 1.41 . . . . 0.0 114.557 179.668 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -132.42 154.9 49.38 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.83 1.252 . . . . 0.0 113.581 -174.644 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.9 tt0 -77.39 152.35 34.42 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.718 0.807 . . . . 0.0 110.128 169.534 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -144.73 126.17 2.58 Favored Glycine 0 N--CA 1.469 0.88 0 N-CA-C 114.88 0.712 . . . . 0.0 114.88 178.545 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -151.06 78.35 1.29 Allowed 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 126.748 2.019 . . . . 0.0 108.931 173.772 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 30.7 mtm 67.18 140.86 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 129.668 3.187 . . . . 0.0 117.112 174.189 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -170.41 166.03 8.58 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.983 1.313 . . . . 0.0 113.489 -169.506 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 66.9 p -74.04 167.69 21.01 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 125.188 1.395 . . . . 0.0 111.497 168.697 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -59.63 -39.07 78.55 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.387 0 O-C-N 120.5 -1.375 . . . . 0.0 111.904 174.029 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -62.28 -44.04 97.44 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.716 1.606 . . . . 0.0 112.876 176.146 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -67.84 -37.46 81.91 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 121.908 -0.495 . . . . 0.0 111.857 172.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 33.3 t -61.5 -43.91 97.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 123.617 0.767 . . . . 0.0 111.317 173.731 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.409 ' HB2' ' CD2' ' A' ' 200' ' ' 44Z . 19.4 ptp -73.08 -23.93 60.6 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 115.579 1.696 . . . . 0.0 115.579 -178.726 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 84.5 t60 -51.72 -44.04 63.07 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 118.73 0.695 . . . . 0.0 110.321 168.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 -74.79 -44.0 51.79 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 170.302 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.6 mp -67.25 -34.42 77.39 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 120.32 1.418 . . . . 0.0 113.873 -177.296 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.45 -47.37 87.98 Favored Glycine 0 CA--C 1.531 1.091 0 CA-C-N 119.222 0.919 . . . . 0.0 111.572 171.514 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 11.2 tp60 -54.93 -46.14 74.89 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.596 1.158 . . . . 0.0 111.604 171.491 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.402 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 68.8 t80 -62.55 -51.37 67.65 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.656 0.782 . . . . 0.0 110.828 179.826 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 67.8 mt -61.67 -37.24 77.51 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 123.758 0.823 . . . . 0.0 111.034 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 35.4 mmt -67.38 -42.45 83.36 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 174.043 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 6.6 p -78.54 -28.75 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 CA-C-N 119.869 1.213 . . . . 0.0 113.386 -177.246 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 57.4 mmtt -92.2 -15.83 27.04 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.905 1.282 . . . . 0.0 113.446 174.46 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 14.1 mp0 53.12 67.19 1.04 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.213 1.805 . . . . 0.0 113.06 -174.243 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.7 tp -90.31 3.83 52.51 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.34 1.056 . . . . 0.0 112.376 179.641 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 40.0 p90 -109.16 160.59 15.96 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 128.183 2.593 . . . . 0.0 110.725 178.194 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -94.54 130.71 40.84 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 109.273 -0.639 . . . . 0.0 109.273 168.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -57.03 -33.81 67.58 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 119.11 0.868 . . . . 0.0 112.737 -175.908 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -87.07 -15.13 39.48 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.873 0.869 . . . . 0.0 112.343 -172.749 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -141.97 57.47 1.48 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 127.875 2.47 . . . . 0.0 110.512 -176.303 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -60.31 -17.46 42.94 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 121.381 -0.824 . . . . 0.0 112.728 178.661 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 6.1 p-80 -63.42 -5.38 3.57 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.272 1.429 . . . . 0.0 114.332 169.619 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 48.1 mtp -128.35 150.75 49.96 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.97 1.259 . . . . 0.0 112.844 169.047 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 t -127.29 140.55 48.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 126.314 1.846 . . . . 0.0 108.243 175.758 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 86.1 m-85 -120.68 68.23 0.86 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.1 0.96 . . . . 0.0 112.622 -168.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 1.9 m -84.81 13.5 5.78 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 -170.269 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.82 -28.63 63.47 Favored Glycine 0 CA--C 1.541 1.705 0 O-C-N 120.473 -1.392 . . . . 0.0 114.663 178.689 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -94.15 5.95 72.04 Favored Glycine 0 CA--C 1.541 1.697 0 C-N-CA 125.358 1.456 . . . . 0.0 115.059 172.87 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -97.81 175.59 6.11 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.914 1.686 . . . . 0.0 112.53 -175.055 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 10.5 mp -59.56 -36.32 75.97 Favored 'General case' 0 CA--C 1.547 0.828 0 O-C-N 121.022 -1.048 . . . . 0.0 111.451 169.402 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 80.5 mt -57.64 -41.54 81.61 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.173 -0.954 . . . . 0.0 111.384 169.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -69.63 -35.3 74.11 Favored Glycine 0 CA--C 1.533 1.169 0 CA-C-O 118.709 -1.05 . . . . 0.0 113.821 176.084 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -72.94 -29.45 63.11 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 120.333 2.067 . . . . 0.0 111.477 176.398 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 29.2 tp -70.79 -50.47 35.4 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.104 1.362 . . . . 0.0 112.449 174.011 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.58 -6.4 23.9 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 124.628 1.171 . . . . 0.0 113.969 -171.182 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.47 -28.88 2.31 Favored Glycine 0 CA--C 1.54 1.647 0 C-N-CA 125.571 1.558 . . . . 0.0 113.759 -171.676 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.89 135.05 11.18 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 128.134 2.574 . . . . 0.0 110.005 176.85 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -148.54 42.75 0.99 Allowed 'General case' 0 N--CA 1.476 0.857 0 CA-C-O 122.283 1.039 . . . . 0.0 110.373 179.239 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 14.8 m -93.54 136.34 33.91 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 121.5 -0.75 . . . . 0.0 110.268 170.122 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 53.8 p90 -158.85 167.52 29.22 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.293 1.037 . . . . 0.0 113.497 -169.65 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 9.7 t -103.7 136.51 43.27 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.57 1.148 . . . . 0.0 111.468 170.29 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 5.5 m -77.83 -11.7 13.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 N-CA-C 114.859 1.429 . . . . 0.0 114.859 178.235 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 18.8 pttm -84.06 -8.53 59.09 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 115.26 1.578 . . . . 0.0 115.26 -176.981 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 42.2 t0 -120.58 96.22 48.93 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 126.148 1.779 . . . . 0.0 111.132 -169.654 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -60.37 -30.89 91.93 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 124.095 3.197 . . . . 0.0 115.315 -178.428 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 69.3 m -60.44 -55.02 49.24 Favored Pre-proline 0 N--CA 1.477 0.905 0 CA-C-N 120.264 1.393 . . . . 0.0 113.913 -177.368 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -67.1 -27.76 41.66 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 122.064 1.842 . . . . 0.0 112.795 175.182 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.423 HD22 ' CE3' ' A' ' 200' ' ' 44Z . 46.4 mt -61.45 -53.95 49.84 Favored 'General case' 0 C--N 1.344 0.341 0 CA-C-N 119.155 0.889 . . . . 0.0 110.535 173.184 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -58.94 -39.38 81.46 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.122 0.873 . . . . 0.0 113.012 176.842 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -58.67 -49.19 78.48 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 118.763 0.71 . . . . 0.0 112.572 177.435 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 45.2 mtm -68.14 -47.38 68.25 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.249 0.62 . . . . 0.0 112.317 175.626 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 69.4 mt -54.52 -47.98 72.48 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.229 1.012 . . . . 0.0 111.034 -178.851 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -59.56 -22.07 61.2 Favored 'General case' 0 N--CA 1.482 1.165 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 175.776 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -88.42 -22.05 23.94 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 125.977 1.711 . . . . 0.0 113.727 173.559 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -111.26 -33.72 6.36 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -170.59 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 42.7 tp -97.7 119.01 35.5 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.957 2.103 . . . . 0.0 108.938 169.137 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 21.4 t -68.84 132.71 32.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 176.57 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 5.2 t -149.65 -177.7 6.03 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.11 0.964 . . . . 0.0 112.426 -174.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -87.17 28.73 0.9 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.496 1.918 . . . . 0.0 114.385 -169.495 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -143.29 159.34 42.52 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.103 1.761 . . . . 0.0 112.836 -172.531 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 62.6 p . . . . . 0 N--CA 1.484 1.243 0 C-N-CA 127.274 2.229 . . . . 0.0 114.291 177.076 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 200' ' ' 44Z . . . . . 0.459 ' CD3' ' CG1' ' A' ' 200' ' ' 44Z . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 31.1 m . . . . . 0 N--CA 1.483 1.181 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 42.7 mtm180 -86.83 143.14 34.99 Favored Pre-proline 0 N--CA 1.48 1.055 0 O-C-N 121.304 -0.873 . . . . 0.0 111.862 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -81.48 -179.28 4.82 Favored 'Trans proline' 0 CA--C 1.535 0.529 0 C-N-CA 124.371 3.381 . . . . 0.0 112.447 173.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.9 ttmt -70.38 149.68 47.05 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.034 0.534 . . . . 0.0 109.932 175.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 85.4 mt -62.44 -41.76 75.8 Favored Pre-proline 0 N--CA 1.478 0.933 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 -168.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -63.33 -29.81 72.76 Favored 'Trans proline' 0 C--N 1.349 0.582 0 CA-C-N 121.58 1.6 . . . . 0.0 114.001 171.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 7.9 tp -64.68 -42.01 95.66 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 119.591 1.087 . . . . 0.0 110.549 172.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.1 tt -64.34 -35.09 79.73 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.012 0.925 . . . . 0.0 111.792 174.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -66.3 -41.39 89.83 Favored 'General case' 0 N--CA 1.483 1.219 0 O-C-N 120.954 -1.091 . . . . 0.0 113.089 170.159 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 74.5 mt -62.46 -39.0 82.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 CA-C-N 119.413 1.006 . . . . 0.0 111.179 173.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 52.4 mt -65.3 -42.12 93.4 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.083 0.953 . . . . 0.0 111.919 173.538 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 34.4 m170 -61.56 -41.13 96.93 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.15 -0.969 . . . . 0.0 112.172 171.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.54 -27.52 69.02 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.89 0.876 . . . . 0.0 112.964 176.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.449 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -74.66 -3.55 31.98 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.303 1.041 . . . . 0.0 113.515 172.157 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 92.28 6.83 64.3 Favored Glycine 0 CA--C 1.537 1.449 0 C-N-CA 125.542 1.544 . . . . 0.0 114.821 -178.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -85.49 168.34 14.63 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 118.745 1.272 . . . . 0.0 113.327 179.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 22.2 tm0? -135.36 140.89 45.39 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.712 1.605 . . . . 0.0 108.157 168.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 175.03 172.93 40.39 Favored Glycine 0 CA--C 1.526 0.73 0 N-CA-C 115.512 0.965 . . . . 0.0 115.512 -176.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -133.23 -58.25 0.9 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 126.227 1.811 . . . . 0.0 109.889 173.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 21.5 mtm -95.62 137.26 34.93 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.049 1.739 . . . . 0.0 111.568 175.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 84.6 m-85 -150.45 138.4 20.08 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.719 1.208 . . . . 0.0 112.532 -178.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 51.1 p -81.94 169.57 16.63 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.164 0.986 . . . . 0.0 110.477 168.172 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -56.39 -36.59 47.51 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 O-C-N 120.459 -1.401 . . . . 0.0 111.434 172.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 54.9 tptt -68.03 -44.79 75.68 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.726 1.211 . . . . 0.0 112.56 176.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 58.5 mt-10 -66.1 -36.81 84.16 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.206 0.602 . . . . 0.0 112.014 176.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 66.8 t -61.87 -50.37 80.43 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 C-N-CA 123.25 0.62 . . . . 0.0 110.409 170.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.35 -39.16 93.78 Favored 'General case' 0 C--N 1.334 -0.094 0 C-N-CA 126.261 1.824 . . . . 0.0 114.279 -172.338 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 83.1 t60 -51.59 -52.57 46.44 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 122.732 0.413 . . . . 0.0 111.309 174.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -74.79 -32.68 62.07 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 115.103 1.519 . . . . 0.0 115.103 174.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -70.25 -40.68 74.28 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 120.779 1.627 . . . . 0.0 112.89 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -60.62 -47.35 91.59 Favored Glycine 0 CA--C 1.53 0.978 0 N-CA-C 110.914 -0.875 . . . . 0.0 110.914 171.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 11.6 tp60 -57.17 -42.37 80.98 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.296 1.038 . . . . 0.0 112.503 173.22 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.449 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 71.3 t80 -63.96 -51.54 63.87 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.817 1.247 . . . . 0.0 110.784 178.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 37.1 mt -61.66 -37.74 78.69 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 C-N-CA 123.869 0.868 . . . . 0.0 110.793 178.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 34.9 mmt -66.73 -43.16 84.93 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 174.047 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 7.4 p -78.49 -28.6 14.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 CA-C-N 119.894 1.225 . . . . 0.0 113.386 -176.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 20.2 mmtp -91.13 -15.81 28.81 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.052 1.341 . . . . 0.0 113.458 173.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 14.6 mp0 54.18 63.34 2.21 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.078 1.751 . . . . 0.0 112.707 -174.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 13.6 tp -92.3 12.59 21.97 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.047 1.339 . . . . 0.0 111.961 -178.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 32.9 p90 -123.02 160.68 25.8 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 128.482 2.713 . . . . 0.0 110.625 -177.115 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.2 t0 -92.82 128.61 38.75 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 169.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.27 -30.95 52.4 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 179.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -94.11 -16.41 23.8 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.004 1.322 . . . . 0.0 112.559 -172.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -139.57 59.46 1.59 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 127.43 2.292 . . . . 0.0 109.83 -177.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -63.23 -17.75 62.79 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.526 0.73 . . . . 0.0 111.961 -178.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 6.4 p-80 -63.91 -1.39 1.41 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.353 1.461 . . . . 0.0 113.429 168.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 36.3 mtp -128.03 145.43 50.99 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 120.293 1.406 . . . . 0.0 111.618 168.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.7 t -127.36 140.26 49.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 125.484 1.514 . . . . 0.0 108.208 173.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 -112.74 52.61 0.77 Allowed 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.378 1.071 . . . . 0.0 113.818 -168.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 32.6 m -70.5 1.73 4.78 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -176.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.57 -25.45 55.36 Favored Glycine 0 CA--C 1.541 1.69 0 CA-C-N 120.558 1.527 . . . . 0.0 114.185 169.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -89.26 5.87 83.86 Favored Glycine 0 CA--C 1.542 1.727 0 C-N-CA 125.375 1.464 . . . . 0.0 115.327 171.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -109.46 172.36 6.9 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.335 1.854 . . . . 0.0 112.058 -174.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 88.5 mt -55.02 -35.62 64.62 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 120.986 -1.071 . . . . 0.0 112.352 169.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.1 tp -60.46 -42.58 96.49 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.738 0.815 . . . . 0.0 111.116 174.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -65.92 -44.36 91.95 Favored Glycine 0 CA--C 1.529 0.937 0 C-N-CA 125.378 1.466 . . . . 0.0 113.627 172.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.2 -26.91 65.96 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.376 1.588 . . . . 0.0 112.356 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 28.2 tp -71.83 -54.56 9.77 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.036 1.334 . . . . 0.0 111.996 169.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -88.64 -5.15 58.34 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-N 118.771 0.714 . . . . 0.0 112.71 -170.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 78.69 -27.89 2.17 Favored Glycine 0 CA--C 1.54 1.605 0 C-N-CA 126.131 1.824 . . . . 0.0 113.291 -170.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.81 134.85 9.0 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 128.28 2.632 . . . . 0.0 109.741 176.317 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -145.17 28.39 1.22 Allowed 'General case' 0 N--CA 1.476 0.863 0 O-C-N 121.3 -0.875 . . . . 0.0 110.876 174.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 14.9 m -87.92 135.61 33.33 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 121.59 -0.694 . . . . 0.0 109.387 170.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 17.5 p90 -158.26 168.75 26.18 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 123.84 0.856 . . . . 0.0 113.215 -169.255 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 14.9 t -110.26 136.19 49.84 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 122.373 1.082 . . . . 0.0 112.217 170.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -78.09 -13.66 13.93 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-N 114.08 -1.418 . . . . 0.0 114.115 -171.321 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 47.5 pttt -81.26 -7.31 59.55 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 125.867 1.667 . . . . 0.0 115.034 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -119.36 85.22 30.66 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 126.07 1.748 . . . . 0.0 110.828 -172.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.25 -27.32 56.15 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.953 3.102 . . . . 0.0 115.261 -172.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 68.2 m -63.59 -55.89 30.8 Favored Pre-proline 0 N--CA 1.478 0.928 0 CA-C-N 119.924 1.238 . . . . 0.0 114.036 -177.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -66.81 -29.55 42.01 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 121.872 1.715 . . . . 0.0 112.341 175.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 25.4 tp -65.48 -43.05 91.46 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.069 0.948 . . . . 0.0 111.583 176.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -60.49 -39.56 88.14 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 121.702 -0.624 . . . . 0.0 111.968 173.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -61.68 -43.28 99.16 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.244 0.618 . . . . 0.0 112.521 176.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 38.2 mtm -64.04 -49.83 70.84 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 173.059 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 65.7 mt -53.25 -48.16 68.46 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.886 1.274 . . . . 0.0 110.855 177.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.64 -18.51 12.38 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.745 1.618 . . . . 0.0 114.881 176.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -96.9 -22.51 16.84 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 125.955 1.702 . . . . 0.0 114.0 172.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -105.28 -26.98 11.79 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 119.818 1.19 . . . . 0.0 113.808 -175.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 3.0 tt . . . . . 0 CA--C 1.54 0.575 0 C-N-CA 125.817 1.647 . . . . 0.0 106.937 169.062 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 23.6 m . . . . . 0 N--CA 1.478 0.954 0 CA-C-O 121.025 0.441 . . . . 0.0 111.778 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 30.8 ttt180 -101.31 123.24 45.41 Favored Pre-proline 0 N--CA 1.476 0.848 0 C-N-CA 124.651 1.181 . . . . 0.0 110.503 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.0 162.31 40.48 Favored 'Trans proline' 0 CA--C 1.535 0.553 0 C-N-CA 123.061 2.507 . . . . 0.0 113.197 170.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.3 tpmt? -61.38 150.42 35.3 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.476 1.11 . . . . 0.0 110.121 175.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 88.3 mt -60.73 -41.6 83.36 Favored Pre-proline 0 N--CA 1.478 0.936 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -170.28 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -65.09 -26.7 57.68 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 121.952 1.768 . . . . 0.0 114.02 172.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.2 tt -72.49 -45.91 57.24 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.06 0.944 . . . . 0.0 109.988 172.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.3 tt -57.79 -33.57 68.69 Favored 'General case' 0 N--CA 1.477 0.919 0 O-C-N 120.782 -1.199 . . . . 0.0 112.237 173.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.75 -28.14 69.76 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 113.742 1.015 . . . . 0.0 113.742 170.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 68.8 mt -67.33 -45.93 84.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 CA-C-N 119.74 1.155 . . . . 0.0 110.319 171.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.03 -40.66 90.08 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.275 0.63 . . . . 0.0 111.015 176.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.8 m170 -64.99 -42.74 94.25 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.758 -0.589 . . . . 0.0 112.51 173.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.34 -28.97 70.07 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.15 -0.969 . . . . 0.0 112.983 176.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.442 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -73.46 -6.08 44.1 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.428 1.091 . . . . 0.0 113.308 172.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.66 7.58 64.67 Favored Glycine 0 CA--C 1.537 1.464 0 C-N-CA 125.374 1.464 . . . . 0.0 115.129 -179.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -88.21 167.58 13.47 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 118.752 1.276 . . . . 0.0 112.745 177.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.8 tm0? -126.71 141.78 51.74 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.286 1.434 . . . . 0.0 109.551 169.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 174.92 167.5 34.29 Favored Glycine 0 N--CA 1.465 0.629 0 N-CA-C 114.726 0.65 . . . . 0.0 114.726 -178.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -126.8 -59.68 1.26 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.57 1.548 . . . . 0.0 109.734 170.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.0 mpp? -93.72 139.98 30.19 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 126.079 1.752 . . . . 0.0 111.126 170.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -146.53 138.97 25.08 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.425 1.49 . . . . 0.0 111.506 178.083 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 41.1 p -74.25 170.52 15.41 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 121.274 -0.891 . . . . 0.0 110.911 168.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.9 t -55.43 -40.53 58.39 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 120.349 -1.469 . . . . 0.0 110.891 169.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -66.96 -43.63 82.63 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.314 1.046 . . . . 0.0 112.695 179.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 64.6 mt-10 -69.79 -33.48 72.44 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 176.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 52.2 t -61.93 -54.87 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 CA-C-N 118.663 0.665 . . . . 0.0 109.49 169.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.3 ttm -61.75 -37.26 83.6 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 126.941 2.096 . . . . 0.0 114.586 -173.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -51.7 -55.19 21.01 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.154 0.582 . . . . 0.0 111.827 172.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 60.0 m-85 -74.82 -30.0 61.25 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 174.338 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -71.67 -39.65 70.15 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 120.277 1.399 . . . . 0.0 112.677 -179.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.16 -39.87 98.21 Favored Glycine 0 CA--C 1.533 1.202 0 CA-C-N 119.395 0.998 . . . . 0.0 111.959 171.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 9.9 tp60 -64.57 -45.74 85.78 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.023 1.329 . . . . 0.0 112.215 172.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.442 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 57.2 t80 -61.35 -49.54 76.55 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 124.21 1.004 . . . . 0.0 109.901 178.125 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 56.7 mt -64.38 -33.63 64.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 C-N-CA 124.322 1.049 . . . . 0.0 111.032 178.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 5.5 tpt -63.46 -39.23 93.9 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 120.23 1.377 . . . . 0.0 112.127 169.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 99.3 t -78.17 -41.53 26.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 O-C-N 120.429 -1.419 . . . . 0.0 112.584 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 52.7 mmtt -85.97 -15.71 40.66 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.082 1.353 . . . . 0.0 112.654 -176.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 48.02 81.29 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 128.558 2.743 . . . . 0.0 114.307 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 37.0 mt -101.86 8.71 41.17 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 125.194 1.398 . . . . 0.0 113.381 -177.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 50.3 p90 -122.58 164.02 18.94 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.325 1.85 . . . . 0.0 111.456 -175.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -91.32 133.46 35.41 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.79 -0.569 . . . . 0.0 111.369 174.232 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.2 -20.92 60.85 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 120.902 -1.124 . . . . 0.0 113.902 173.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -81.79 -32.03 31.53 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.543 1.137 . . . . 0.0 111.157 179.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -146.2 74.4 1.37 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 127.604 2.361 . . . . 0.0 110.311 -169.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 29.1 mp0 -60.41 -23.9 64.73 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 120.859 -1.151 . . . . 0.0 112.58 178.126 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 5.6 p-80 -67.4 -6.91 21.28 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.385 1.474 . . . . 0.0 114.502 171.065 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 1.9 tpt -111.98 126.77 55.5 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 126.749 2.02 . . . . 0.0 109.726 173.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.4 t -126.07 133.77 68.1 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.766 1.227 . . . . 0.0 110.062 -178.113 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -118.51 100.12 7.25 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.929 1.692 . . . . 0.0 109.086 173.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 61.4 m -99.43 14.51 29.51 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.509 0.724 . . . . 0.0 112.737 175.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.19 -27.25 68.77 Favored Glycine 0 CA--C 1.538 1.527 0 O-C-N 120.639 -1.288 . . . . 0.0 114.518 -177.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -90.03 4.61 83.17 Favored Glycine 0 CA--C 1.54 1.639 0 C-N-CA 125.145 1.355 . . . . 0.0 114.995 172.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -106.89 172.01 7.05 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.772 1.629 . . . . 0.0 112.669 -174.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 10.9 mp -53.45 -34.12 56.68 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.396 1.478 . . . . 0.0 112.663 169.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 98.7 mt -61.08 -47.15 87.67 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 121.111 -0.993 . . . . 0.0 111.654 170.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -63.3 -38.6 96.7 Favored Glycine 0 CA--C 1.533 1.171 0 CA-C-O 119.16 -0.8 . . . . 0.0 112.889 173.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.65 -29.66 62.47 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 119.715 1.758 . . . . 0.0 112.973 -179.497 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.1 pp -81.4 -34.72 31.45 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 175.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -100.4 -9.68 21.96 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 119.17 0.895 . . . . 0.0 113.15 -177.404 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.49 -27.1 3.33 Favored Glycine 0 CA--C 1.54 1.634 0 C-N-CA 125.525 1.536 . . . . 0.0 112.905 -169.298 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.68 138.36 6.05 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 128.032 2.533 . . . . 0.0 111.282 178.512 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -144.21 69.2 1.27 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.836 0.854 . . . . 0.0 109.149 168.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -105.02 124.88 50.3 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 169.421 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 49.8 p90 -157.22 156.03 31.85 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.18 0.992 . . . . 0.0 112.118 -169.32 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 10.5 m -107.65 135.8 48.48 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.076 171.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . 0.264 0.2 OUTLIER -78.23 -14.5 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 -169.412 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -75.5 -7.9 55.33 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 125.562 1.545 . . . . 0.0 114.832 174.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -116.67 95.35 45.97 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 126.719 2.008 . . . . 0.0 110.334 -172.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -62.45 -28.36 77.91 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.965 3.11 . . . . 0.0 115.249 -178.039 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 67.3 m -58.85 -53.89 61.84 Favored Pre-proline 0 N--CA 1.477 0.885 0 CA-C-N 120.121 1.328 . . . . 0.0 113.834 -178.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -65.52 -28.31 53.56 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 122.099 1.866 . . . . 0.0 113.187 174.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 49.4 mt -62.92 -50.89 69.07 Favored 'General case' 0 C--N 1.344 0.356 0 CA-C-N 119.6 1.091 . . . . 0.0 111.13 174.009 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -60.48 -40.84 92.76 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 118.883 -0.579 . . . . 0.0 112.146 174.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -61.46 -49.65 75.97 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 119.229 0.922 . . . . 0.0 112.845 179.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 31.4 mtm -60.78 -49.64 76.67 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.657 0.783 . . . . 0.0 112.211 175.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 10.2 mp -65.97 -42.38 89.96 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 118.542 -0.742 . . . . 0.0 111.814 -176.433 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -57.28 -20.27 27.0 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 119.835 1.198 . . . . 0.0 113.842 172.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 90.4 mttt -95.84 -13.87 23.68 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.77 1.628 . . . . 0.0 114.404 174.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 8.1 p-10 -124.8 -16.33 6.21 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 116.154 1.909 . . . . 0.0 116.154 -178.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 57.4 tp . . . . . 0 CA--C 1.537 0.451 0 C-N-CA 127.358 2.263 . . . . 0.0 108.858 176.434 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 32.6 m . . . . . 0 N--CA 1.483 1.198 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 24.0 ttp-105 -99.49 134.47 21.15 Favored Pre-proline 0 N--CA 1.481 1.111 0 O-C-N 120.847 -1.158 . . . . 0.0 111.802 178.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -71.46 171.29 16.51 Favored 'Trans proline' 0 C--N 1.354 0.832 0 C-N-CA 123.624 2.883 . . . . 0.0 112.65 175.437 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.6 tpmt? -62.01 146.66 49.52 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.251 1.02 . . . . 0.0 110.739 178.271 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 90.2 mt -55.3 -49.22 93.64 Favored Pre-proline 0 N--CA 1.474 0.769 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 -173.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -65.11 -21.09 63.22 Favored 'Trans proline' 0 CA--C 1.54 0.807 0 CA-C-N 122.034 1.762 . . . . 0.0 113.856 177.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.2 tt -75.72 -46.36 31.52 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.247 0.93 . . . . 0.0 109.657 169.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.1 tp -57.01 -34.62 68.36 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.246 -0.909 . . . . 0.0 113.285 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -64.3 -22.4 66.94 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 121.271 -0.893 . . . . 0.0 113.34 175.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 51.7 mt -70.23 -39.67 77.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 123.93 0.892 . . . . 0.0 110.363 171.595 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.9 mp -70.01 -35.37 74.31 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.347 -0.846 . . . . 0.0 111.279 175.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 57.7 m170 -61.03 -46.32 91.23 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 118.208 0.458 . . . . 0.0 111.263 169.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.65 -24.68 67.89 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 175.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.415 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -71.58 -6.31 39.81 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 172.054 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.72 17.59 47.98 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 125.039 1.304 . . . . 0.0 115.069 177.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -121.13 150.01 41.91 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.043 1.337 . . . . 0.0 112.71 -179.08 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -74.46 171.12 14.34 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.486 0.714 . . . . 0.0 111.548 169.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -169.06 133.1 2.74 Favored Glycine 0 C--N 1.341 0.817 0 N-CA-C 117.487 1.755 . . . . 0.0 117.487 -178.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -140.56 -13.41 0.99 Allowed 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 173.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 3.2 mtm -171.04 134.08 0.92 Allowed 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 126.539 1.936 . . . . 0.0 111.391 -175.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -155.1 147.5 24.0 Favored 'General case' 0 CA--C 1.55 0.974 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 -173.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 50.7 p -94.97 171.84 8.51 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 127.106 2.162 . . . . 0.0 110.371 168.234 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -52.09 -48.02 42.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 CA-C-N 120.356 1.435 . . . . 0.0 110.428 169.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -53.32 -37.84 62.65 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.114 0.966 . . . . 0.0 113.091 -179.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -80.82 -42.98 20.75 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.248 1.019 . . . . 0.0 112.726 176.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 75.6 t -64.18 -48.32 86.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 O-C-N 120.851 -1.156 . . . . 0.0 111.775 -179.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.4 mmm -72.66 -25.8 61.4 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 118.906 0.775 . . . . 0.0 112.421 -174.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 77.1 t60 -60.56 -54.52 44.44 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.678 0.791 . . . . 0.0 110.804 169.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 53.6 m-85 -72.37 -32.62 66.58 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 113.58 0.955 . . . . 0.0 113.58 179.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.9 mp -69.91 -40.64 75.48 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.882 1.219 . . . . 0.0 112.197 172.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.22 -42.91 99.72 Favored Glycine 0 CA--C 1.529 0.959 0 CA-C-N 118.979 0.809 . . . . 0.0 111.847 172.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.7 tp60 -58.52 -47.03 85.51 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.554 1.141 . . . . 0.0 111.973 171.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.415 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 28.3 t80 -60.7 -49.59 76.9 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.323 0.649 . . . . 0.0 110.752 175.799 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 54.6 mt -57.68 -37.83 61.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 124.868 1.267 . . . . 0.0 111.125 177.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -69.24 -37.56 78.05 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.876 0.87 . . . . 0.0 113.136 174.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 81.4 t -78.23 -31.5 16.34 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 124.179 0.992 . . . . 0.0 112.524 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 54.3 mmtt -92.34 -14.72 28.32 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.894 1.278 . . . . 0.0 113.152 176.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.7 mp0 53.61 61.16 3.24 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.467 1.907 . . . . 0.0 113.134 -172.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.4 mp -95.69 6.16 49.62 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.003 1.321 . . . . 0.0 113.539 -179.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 52.4 p90 -89.88 158.95 17.2 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.823 1.649 . . . . 0.0 110.691 169.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -85.27 123.37 30.67 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.589 -0.694 . . . . 0.0 110.904 170.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.4 -22.07 66.74 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 120.895 -1.128 . . . . 0.0 112.865 178.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 48.2 mm-40 -78.7 -26.94 44.92 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.357 -0.839 . . . . 0.0 111.035 -176.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -160.25 83.71 0.71 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 127.189 2.196 . . . . 0.0 110.906 -171.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -60.58 -14.24 18.96 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.626 1.57 . . . . 0.0 115.089 -169.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 22.6 p80 -65.31 -23.44 67.02 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 118.112 -0.947 . . . . 0.0 113.082 171.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 42.3 mmm -83.88 139.91 32.32 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 119.67 1.123 . . . . 0.0 112.843 173.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 60.4 t -120.86 133.45 67.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 127.794 2.437 . . . . 0.0 107.0 169.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 10.5 t80 -121.38 13.34 11.04 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 116.833 2.161 . . . . 0.0 116.833 -168.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 15.9 p 39.06 31.33 0.05 OUTLIER 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 128.407 2.683 . . . . 0.0 117.542 175.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.34 108.34 1.89 Allowed Glycine 0 CA--C 1.534 1.269 0 O-C-N 120.897 -1.127 . . . . 0.0 113.348 -171.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 68.45 14.06 66.29 Favored Glycine 0 CA--C 1.54 1.62 0 C-N-CA 124.21 0.91 . . . . 0.0 114.895 -175.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -75.45 155.27 36.45 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 118.682 1.241 . . . . 0.0 112.265 -177.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 81.8 mt -62.53 -32.5 73.46 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.412 1.485 . . . . 0.0 111.56 169.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 84.8 mt -54.81 -48.04 73.3 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.7 0.8 . . . . 0.0 111.354 171.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -71.78 -38.76 60.66 Favored Glycine 0 CA--C 1.53 0.976 0 C-N-CA 124.42 1.009 . . . . 0.0 112.989 178.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.93 -26.62 65.17 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 119.673 1.736 . . . . 0.0 112.481 177.457 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 47.7 tp -76.12 -56.32 4.76 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.397 1.479 . . . . 0.0 112.181 173.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.31 -7.73 41.01 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 113.469 0.915 . . . . 0.0 113.469 -169.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 80.66 -25.64 3.34 Favored Glycine 0 CA--C 1.539 1.558 0 C-N-CA 125.756 1.646 . . . . 0.0 113.34 -169.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.6 137.2 11.03 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 126.801 2.041 . . . . 0.0 112.058 178.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -148.14 49.06 1.05 Allowed 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.686 1.195 . . . . 0.0 110.429 168.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 8.1 p -89.85 137.53 32.26 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 121.327 -0.858 . . . . 0.0 110.063 169.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 46.6 p90 -171.82 167.95 6.2 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.519 0.728 . . . . 0.0 112.064 -169.151 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 60.2 p -121.21 143.83 48.93 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.071 -0.968 . . . . 0.0 113.51 173.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 27.1 m -74.39 -12.86 15.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 -179.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.39 -0.48 46.2 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.778 1.631 . . . . 0.0 114.586 170.5 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 40.8 t0 -126.85 77.39 74.65 Favored Pre-proline 0 CA--C 1.551 1.015 0 C-N-CA 127.135 2.174 . . . . 0.0 109.95 171.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_exo -56.64 -40.88 81.33 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 124.623 3.549 . . . . 0.0 114.882 -175.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 55.6 m -52.92 -54.86 39.24 Favored Pre-proline 0 N--CA 1.476 0.848 0 N-CA-C 114.838 1.421 . . . . 0.0 114.838 -172.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -65.81 -30.46 49.62 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 122.336 2.024 . . . . 0.0 113.425 175.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.45 ' HA ' ' HE2' ' A' ' 101' ' ' MET . 37.0 tp -66.95 -47.28 72.13 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.003 0.921 . . . . 0.0 110.672 176.103 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -58.23 -40.53 81.93 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.721 0.808 . . . . 0.0 112.228 171.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -60.11 -51.04 71.31 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 119.729 1.15 . . . . 0.0 112.902 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.45 ' HE2' ' HA ' ' A' ' 98' ' ' LEU . 64.7 mtm -63.6 -44.5 93.8 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.034 0.534 . . . . 0.0 112.116 175.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 66.4 mt -61.5 -46.74 88.73 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-O 117.732 -1.128 . . . . 0.0 111.326 178.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 42.1 ttt180 -56.37 -24.98 47.9 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 121.265 1.848 . . . . 0.0 113.547 174.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -85.17 -17.9 35.77 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.561 1.544 . . . . 0.0 114.012 174.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -123.36 -6.39 8.22 Favored 'General case' 0 CA--C 1.558 1.273 0 N-CA-C 115.698 1.74 . . . . 0.0 115.698 178.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 68.8 tp . . . . . 0 CA--C 1.541 0.597 0 C-N-CA 128.512 2.725 . . . . 0.0 109.679 -174.079 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 33.7 m . . . . . 0 N--CA 1.48 1.074 0 N-CA-C 111.656 0.243 . . . . 0.0 111.656 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.3 ttp-105 -95.42 133.66 25.55 Favored Pre-proline 0 N--CA 1.48 1.037 0 O-C-N 120.991 -1.068 . . . . 0.0 111.522 172.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -68.38 171.44 12.88 Favored 'Trans proline' 0 C--N 1.354 0.857 0 C-N-CA 123.799 3.0 . . . . 0.0 113.501 176.05 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.5 ttmt -62.86 149.62 43.9 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.142 0.977 . . . . 0.0 110.685 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 81.3 mt -61.66 -43.11 87.12 Favored Pre-proline 0 N--CA 1.476 0.866 0 N-CA-C 115.062 1.504 . . . . 0.0 115.062 -168.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -65.0 -28.41 57.66 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.035 1.824 . . . . 0.0 113.752 172.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 5.1 tt -67.49 -49.19 64.63 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 119.221 0.919 . . . . 0.0 109.499 172.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 13.9 tp -60.24 -33.07 71.77 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 121.294 -0.879 . . . . 0.0 112.784 177.41 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -58.66 -27.69 65.02 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 174.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 60.0 mt -72.99 -39.13 57.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.17 0.988 . . . . 0.0 110.998 175.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.3 mp -68.08 -34.85 77.19 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.477 -0.764 . . . . 0.0 110.953 174.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 60.4 m170 -61.94 -44.58 96.47 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 121.998 -0.439 . . . . 0.0 111.513 169.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -65.02 -26.99 68.51 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 175.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.33 -3.41 26.97 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.352 1.061 . . . . 0.0 113.435 171.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.67 15.26 57.02 Favored Glycine 0 CA--C 1.535 1.317 0 C-N-CA 125.021 1.296 . . . . 0.0 115.309 174.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -117.13 145.34 43.86 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.943 1.297 . . . . 0.0 112.551 -179.114 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -75.06 170.69 15.51 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.255 0.622 . . . . 0.0 111.329 169.461 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -173.0 143.74 7.44 Favored Glycine 0 C--N 1.34 0.765 0 N-CA-C 117.324 1.69 . . . . 0.0 117.324 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -140.7 -11.22 1.02 Allowed 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 175.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.5 mtm -169.68 130.18 1.03 Allowed 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 125.744 1.618 . . . . 0.0 111.579 -175.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -155.82 139.5 16.06 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -175.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 64.8 p -80.77 176.02 10.17 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.792 0.837 . . . . 0.0 109.646 166.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -59.34 -37.64 70.41 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.324 0 O-C-N 120.262 -1.524 . . . . 0.0 111.651 172.381 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -66.97 -42.19 85.57 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.865 1.666 . . . . 0.0 113.059 175.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -70.34 -35.06 73.36 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.776 -0.577 . . . . 0.0 112.094 174.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 18.7 t -60.38 -48.91 86.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 124.085 0.954 . . . . 0.0 110.844 169.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -62.34 -36.43 82.16 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 127.097 2.159 . . . . 0.0 114.178 -173.176 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -51.7 -53.02 43.74 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 122.857 0.463 . . . . 0.0 111.956 170.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -74.7 -31.66 61.94 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 114.296 1.221 . . . . 0.0 114.296 175.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -72.14 -41.93 66.58 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.971 1.26 . . . . 0.0 112.876 -179.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -60.46 -42.94 99.22 Favored Glycine 0 CA--C 1.532 1.126 0 CA-C-N 118.826 0.739 . . . . 0.0 111.559 171.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.2 tp60 -61.61 -42.26 98.63 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.77 1.228 . . . . 0.0 112.648 173.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -64.45 -51.88 60.83 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.307 1.043 . . . . 0.0 110.42 177.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 55.8 mt -60.85 -37.4 76.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 O-C-N 121.501 -0.749 . . . . 0.0 110.597 179.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.2 tpt -63.88 -46.57 84.33 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.88 1.272 . . . . 0.0 112.892 173.59 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.3 p -78.5 -27.24 14.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 CA-C-N 119.73 1.15 . . . . 0.0 113.683 -176.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 55.0 mmtt -90.48 -15.72 30.27 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 125.074 1.349 . . . . 0.0 113.365 173.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.4 mp0 54.35 60.08 3.79 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 127.034 2.134 . . . . 0.0 113.105 -174.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.9 tp -95.62 6.18 49.6 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.08 0.952 . . . . 0.0 113.301 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 47.4 p90 -95.68 159.8 14.81 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 126.109 1.763 . . . . 0.0 111.022 173.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -86.07 129.24 34.9 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.518 -0.739 . . . . 0.0 111.836 172.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.35 -24.26 66.48 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 120.799 -1.188 . . . . 0.0 112.752 176.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 49.7 mm-40 -78.68 -30.57 46.23 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.28 -0.887 . . . . 0.0 110.756 -176.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -151.72 80.58 1.28 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 128.036 2.534 . . . . 0.0 110.159 -169.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 27.2 mp0 -60.76 -15.54 30.67 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 114.292 1.219 . . . . 0.0 114.292 -174.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 21.6 p80 -64.31 -22.51 66.98 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 118.402 -0.809 . . . . 0.0 113.113 171.548 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.8 ttm -96.88 137.27 36.23 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 119.838 1.199 . . . . 0.0 112.783 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 52.7 t -132.06 138.32 52.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 126.419 1.888 . . . . 0.0 110.18 -179.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -104.16 51.02 0.78 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.934 1.293 . . . . 0.0 113.889 -171.007 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 90.4 m -69.39 -1.61 8.82 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 115.321 1.6 . . . . 0.0 115.321 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.36 -25.19 60.1 Favored Glycine 0 CA--C 1.539 1.578 0 CA-C-N 120.462 1.483 . . . . 0.0 113.686 169.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -91.57 9.96 75.84 Favored Glycine 0 CA--C 1.54 1.653 0 C-N-CA 125.506 1.526 . . . . 0.0 115.064 170.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -119.6 174.83 6.17 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.539 1.536 . . . . 0.0 112.689 -173.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -49.84 -40.17 41.32 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.004 1.722 . . . . 0.0 111.933 176.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 63.1 mt -62.56 -38.12 88.83 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 120.746 0.307 . . . . 0.0 111.155 178.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -79.12 -29.09 52.16 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 125.381 1.467 . . . . 0.0 113.593 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -67.47 -42.23 83.33 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 120.491 2.145 . . . . 0.0 109.606 169.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 24.1 tp -60.66 -48.46 81.69 Favored 'General case' 0 CA--C 1.552 1.023 0 CA-C-N 114.974 -1.012 . . . . 0.0 112.76 177.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 8.1 mt -94.17 -7.39 42.42 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 116.044 1.868 . . . . 0.0 116.044 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.81 -16.33 11.93 Favored Glycine 0 CA--C 1.543 1.836 0 O-C-N 120.701 -1.249 . . . . 0.0 113.797 -169.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.23 155.35 26.88 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 129.024 2.93 . . . . 0.0 109.322 173.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -164.03 25.57 0.07 Allowed 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 119.229 0.922 . . . . 0.0 112.215 169.294 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 17.2 m -84.97 132.01 34.41 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 120.999 -1.063 . . . . 0.0 108.681 175.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 6.3 p90 -161.26 178.57 9.11 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 -167.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 96.7 p -122.88 137.67 54.87 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 114.423 -1.262 . . . . 0.0 113.314 173.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 15.3 m -73.74 -17.05 17.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 -173.399 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.7 pttt -82.53 -6.31 59.25 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.039 1.736 . . . . 0.0 115.046 -177.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -118.73 83.33 22.1 Favored Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 126.119 1.768 . . . . 0.0 110.585 -173.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.28 -30.69 54.1 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 124.083 3.189 . . . . 0.0 115.315 -169.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 66.9 m -61.72 -53.96 55.95 Favored Pre-proline 0 N--CA 1.475 0.817 0 CA-C-N 119.698 1.136 . . . . 0.0 113.995 -176.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -69.37 -28.38 27.18 Favored 'Trans proline' 0 C--N 1.354 0.818 0 C-N-CA 121.869 1.713 . . . . 0.0 112.764 175.109 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 18.7 tp -66.77 -44.51 81.19 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.884 1.274 . . . . 0.0 111.914 179.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -55.48 -39.09 69.98 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.8 1.24 . . . . 0.0 112.947 176.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -59.7 -47.18 86.67 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.717 0.807 . . . . 0.0 112.396 177.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 16.7 mtm -69.21 -41.85 76.54 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 178.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 65.9 mt -55.34 -54.96 37.06 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.441 1.096 . . . . 0.0 110.588 175.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 72.7 ttt180 -52.44 -31.97 37.17 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.247 1.419 . . . . 0.0 113.223 178.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -78.78 -29.57 45.1 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.272 1.429 . . . . 0.0 113.757 176.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 31.3 m-20 -109.74 -19.16 13.26 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -171.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 47.7 tp . . . . . 0 CA--C 1.535 0.4 0 C-N-CA 126.218 1.807 . . . . 0.0 106.436 168.42 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.4 m . . . . . 0 N--CA 1.483 1.175 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.1 ttp-105 -87.59 138.53 31.69 Favored Pre-proline 0 N--CA 1.481 1.094 0 C-N-CA 125.175 1.39 . . . . 0.0 111.814 178.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -73.89 177.75 7.73 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 123.959 3.106 . . . . 0.0 113.71 175.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 32.1 ttmt -69.86 155.21 40.9 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.456 1.102 . . . . 0.0 111.296 179.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 68.4 mt -56.25 -45.71 99.88 Favored Pre-proline 0 CA--C 1.544 0.726 0 N-CA-C 116.346 1.98 . . . . 0.0 116.346 -168.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -64.19 -29.46 64.62 Favored 'Trans proline' 0 C--N 1.351 0.693 0 CA-C-N 122.152 1.804 . . . . 0.0 113.262 175.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.3 tt -71.27 -42.53 68.64 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.068 0.849 . . . . 0.0 110.14 176.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 11.5 tp -58.57 -37.15 75.14 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.514 -0.741 . . . . 0.0 111.408 170.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.7 -37.09 85.5 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.146 0.979 . . . . 0.0 113.432 175.262 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 87.8 mt -62.57 -44.53 99.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 CA-C-N 119.043 0.838 . . . . 0.0 110.973 170.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 71.2 mt -62.39 -37.54 86.15 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.529 0.732 . . . . 0.0 111.857 175.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -63.43 -45.28 91.66 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 121.195 -0.941 . . . . 0.0 112.368 169.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.62 -27.06 68.97 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.017 0.927 . . . . 0.0 113.085 177.368 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.463 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -71.49 -7.29 46.57 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.352 1.061 . . . . 0.0 113.447 173.03 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 93.18 8.6 61.33 Favored Glycine 0 CA--C 1.537 1.447 0 C-N-CA 125.537 1.541 . . . . 0.0 114.952 -178.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -97.62 173.94 6.89 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.891 1.276 . . . . 0.0 113.062 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 15.5 tp60 -129.51 149.19 51.39 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 126.511 1.924 . . . . 0.0 108.92 169.407 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . 0.404 ' HA3' ' CZ ' ' A' ' 47' ' ' PHE . . . -158.68 148.92 18.73 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 116.421 1.328 . . . . 0.0 116.421 -174.053 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -133.41 -14.77 2.54 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.973 1.309 . . . . 0.0 113.829 174.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 6.0 mtm -175.41 137.18 0.37 Allowed 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 129.231 3.012 . . . . 0.0 109.367 -178.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.404 ' CZ ' ' HA3' ' A' ' 44' ' ' GLY . 0.0 OUTLIER -158.54 170.21 22.7 Favored 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 114.317 1.228 . . . . 0.0 114.317 174.062 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 70.5 p -90.44 171.62 9.3 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 126.295 1.838 . . . . 0.0 112.131 173.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.8 t -51.56 -44.08 33.19 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 123.634 0.774 . . . . 0.0 110.761 169.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -67.69 -42.86 81.4 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 125.155 1.382 . . . . 0.0 112.89 -179.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -72.52 -32.68 66.32 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 118.433 0.56 . . . . 0.0 112.469 179.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 43.7 t -63.87 -49.28 82.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 123.459 0.703 . . . . 0.0 109.703 169.155 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -65.22 -34.0 77.33 Favored 'General case' 0 N--CA 1.458 -0.072 0 C-N-CA 126.871 2.069 . . . . 0.0 114.301 -176.3 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -51.56 -52.9 43.38 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.543 0.737 . . . . 0.0 111.257 172.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -74.78 -32.83 62.15 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.896 1.443 . . . . 0.0 114.896 172.065 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.67 -41.41 75.54 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 120.674 1.579 . . . . 0.0 113.053 -178.507 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.27 -39.75 98.21 Favored Glycine 0 CA--C 1.533 1.178 0 CA-C-N 118.678 0.672 . . . . 0.0 111.817 173.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.5 tp60 -62.8 -45.33 93.16 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.786 1.234 . . . . 0.0 112.045 172.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.463 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 60.2 t80 -60.76 -49.71 76.41 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.896 0.879 . . . . 0.0 110.426 177.176 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 53.3 mt -62.21 -34.98 66.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 C-N-CA 124.019 0.928 . . . . 0.0 111.236 177.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.76 -38.61 91.58 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 119.575 1.08 . . . . 0.0 112.358 172.102 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 96.5 t -78.28 -34.76 18.88 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 C-N-CA 124.334 1.053 . . . . 0.0 112.998 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 19.0 mmtp -90.16 -14.94 32.51 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.961 1.304 . . . . 0.0 113.328 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.2 mp0 47.34 62.2 2.53 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 127.269 2.228 . . . . 0.0 113.876 -172.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 31.6 mt -82.66 -13.11 57.03 Favored 'General case' 0 N--CA 1.478 0.974 0 O-C-N 121.306 -0.871 . . . . 0.0 112.548 175.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 44.5 p90 -78.69 152.47 31.59 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.045 0.938 . . . . 0.0 111.744 176.12 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -83.41 127.2 33.49 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 121.834 -0.541 . . . . 0.0 110.619 169.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -65.8 -24.47 66.92 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.1 -1.0 . . . . 0.0 113.515 -176.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -85.5 -30.08 23.73 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-O 121.385 0.612 . . . . 0.0 111.337 -171.117 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -148.54 87.82 1.6 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 128.587 2.755 . . . . 0.0 110.064 178.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 29.2 mp0 -61.2 -14.24 24.03 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 -172.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 23.9 p80 -61.74 -30.76 70.99 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 118.278 -0.868 . . . . 0.0 112.378 170.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 21.5 tpp -83.07 128.53 34.57 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 119.781 1.173 . . . . 0.0 111.036 177.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 3.3 t -120.91 122.49 67.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 C-N-CA 126.106 1.762 . . . . 0.0 108.857 174.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -107.49 107.09 17.79 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.509 1.524 . . . . 0.0 109.796 178.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 84.2 m -99.8 20.04 14.91 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.253 1.021 . . . . 0.0 113.27 -177.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.69 122.98 31.85 Favored Glycine 0 CA--C 1.534 1.264 0 O-C-N 120.937 -1.102 . . . . 0.0 111.872 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 78.27 0.4 77.52 Favored Glycine 0 CA--C 1.54 1.65 0 C-N-CA 124.488 1.042 . . . . 0.0 115.374 -174.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -80.72 162.77 23.97 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 119.278 1.539 . . . . 0.0 111.657 171.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -46.47 -40.81 12.99 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.623 1.569 . . . . 0.0 111.743 170.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 97.1 mt -60.18 -43.66 95.68 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.088 0.955 . . . . 0.0 111.998 176.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -71.49 -34.15 63.62 Favored Glycine 0 CA--C 1.533 1.19 0 C-N-CA 124.99 1.281 . . . . 0.0 114.061 176.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -66.85 -42.64 85.4 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 120.637 2.219 . . . . 0.0 110.487 174.061 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 27.1 tp -61.51 -52.65 63.59 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 115.085 -0.961 . . . . 0.0 112.456 177.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -101.91 -6.8 23.06 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -169.568 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.86 -29.22 2.41 Favored Glycine 0 CA--C 1.54 1.651 0 O-C-N 120.349 -1.469 . . . . 0.0 112.805 -169.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.84 135.86 7.65 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 127.633 2.373 . . . . 0.0 111.926 179.012 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 11.6 mt-30 -142.38 45.84 1.62 Allowed 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.29 1.036 . . . . 0.0 109.831 168.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 1.6 m -86.33 128.41 34.92 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 121.161 -0.962 . . . . 0.0 109.184 169.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 17.8 p90 -158.02 168.63 26.59 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.496 0.718 . . . . 0.0 112.856 -169.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 34.6 t -118.61 138.04 52.85 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.828 170.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -77.53 -1.43 3.86 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 12.6 pttp -84.29 -7.81 59.22 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.565 1.146 . . . . 0.0 113.702 169.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -122.89 83.25 49.92 Favored Pre-proline 0 CA--C 1.55 0.981 0 C-N-CA 126.487 1.915 . . . . 0.0 110.819 -170.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -67.46 -27.88 39.28 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.88 3.054 . . . . 0.0 115.269 -170.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 59.6 m -61.79 -53.71 57.97 Favored Pre-proline 0 N--CA 1.477 0.902 0 CA-C-N 119.867 1.212 . . . . 0.0 114.192 -177.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -67.21 -29.98 38.35 Favored 'Trans proline' 0 C--N 1.353 0.777 0 C-N-CA 121.93 1.753 . . . . 0.0 112.636 175.225 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 27.9 tp -65.35 -44.14 88.64 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.408 1.083 . . . . 0.0 111.551 177.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 25.7 t80 -60.43 -36.39 78.07 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.865 1.266 . . . . 0.0 112.195 174.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -65.47 -47.17 77.03 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.664 0.785 . . . . 0.0 112.712 175.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 31.1 mtm -57.59 -49.66 75.68 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.024 0.53 . . . . 0.0 111.768 174.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 7.5 mp -63.11 -47.89 80.86 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-O 117.294 -1.336 . . . . 0.0 111.125 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 61.7 mtp180 -52.0 -29.65 21.73 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-N 121.067 1.758 . . . . 0.0 113.757 175.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -85.82 -20.21 29.5 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.594 1.557 . . . . 0.0 114.879 177.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -126.69 -25.64 3.36 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 115.29 1.589 . . . . 0.0 115.29 -174.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 44.7 tp . . . . . 0 CA--C 1.54 0.56 0 C-N-CA 127.619 2.368 . . . . 0.0 107.179 170.862 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 34.8 m . . . . . 0 N--CA 1.484 1.241 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.4 ptt-85 -94.29 156.98 38.25 Favored Pre-proline 0 N--CA 1.488 1.425 0 C-N-CA 124.65 1.18 . . . . 0.0 112.015 169.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -68.06 176.43 5.41 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 123.839 3.026 . . . . 0.0 112.756 169.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 24.4 ttmt -65.11 148.06 52.35 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.136 0.974 . . . . 0.0 111.2 179.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 81.8 mt -53.4 -50.74 81.15 Favored Pre-proline 0 N--CA 1.477 0.914 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -169.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -64.43 -22.07 65.96 Favored 'Trans proline' 0 CA--C 1.54 0.777 0 C-N-CA 122.262 1.975 . . . . 0.0 114.142 175.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.1 tt -77.9 -37.51 47.81 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 119.825 1.193 . . . . 0.0 110.54 169.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 16.2 tp -58.58 -35.09 71.86 Favored 'General case' 0 N--CA 1.475 0.775 0 O-C-N 120.765 -1.209 . . . . 0.0 112.264 171.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.439 ' HA ' ' HE2' ' A' ' 35' ' ' LYS . 9.0 mmpt? -59.84 -26.62 65.96 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 172.131 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 81.8 mt -73.04 -36.98 52.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 123.977 0.911 . . . . 0.0 110.662 176.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.4 mp -70.51 -34.3 72.17 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.152 -0.967 . . . . 0.0 111.279 172.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 43.6 m170 -63.15 -42.44 99.44 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.796 -0.565 . . . . 0.0 111.532 169.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.79 -28.54 69.94 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.153 0.981 . . . . 0.0 113.166 173.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.453 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -70.54 -6.51 36.87 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 124.153 0.981 . . . . 0.0 113.33 171.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 92.47 16.54 49.14 Favored Glycine 0 CA--C 1.535 1.344 0 C-N-CA 125.309 1.433 . . . . 0.0 115.142 177.394 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -123.76 139.99 53.43 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 118.77 1.285 . . . . 0.0 113.421 -176.316 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -77.04 151.86 35.36 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.164 0.986 . . . . 0.0 110.192 169.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -165.32 146.89 11.64 Favored Glycine 0 CA--C 1.527 0.834 0 N-CA-C 115.221 0.848 . . . . 0.0 115.221 176.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -137.58 -14.03 1.48 Allowed 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 114.687 1.365 . . . . 0.0 114.687 -175.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 5.9 mtm -176.45 126.35 0.19 Allowed 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 128.44 2.696 . . . . 0.0 109.658 -176.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -170.42 152.03 3.89 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 114.507 1.299 . . . . 0.0 114.507 176.572 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 42.9 p -75.41 175.32 8.55 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 126.351 1.861 . . . . 0.0 113.163 176.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 8.9 t -54.54 -50.1 61.29 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 O-C-N 120.614 -1.304 . . . . 0.0 110.401 169.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -56.43 -37.37 70.12 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.287 0.949 . . . . 0.0 112.587 -177.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -79.23 -30.79 43.38 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.687 1.195 . . . . 0.0 113.474 176.013 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 49.6 t -75.28 -46.05 39.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.124 0.97 . . . . 0.0 111.777 176.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 29.4 mmt -62.36 -26.81 68.66 Favored 'General case' 0 N--CA 1.483 1.221 0 CA-C-N 119.907 1.231 . . . . 0.0 113.116 -177.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -51.56 -52.95 43.04 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.18 170.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -74.88 -36.99 62.25 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 170.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -75.18 -41.47 57.94 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 120.831 -1.168 . . . . 0.0 112.898 -171.578 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -64.11 -35.92 92.59 Favored Glycine 0 CA--C 1.531 1.052 0 O-C-N 121.654 -0.654 . . . . 0.0 111.814 171.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 9.1 tp60 -64.48 -44.55 90.65 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.679 1.191 . . . . 0.0 111.912 171.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.453 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 42.6 t80 -60.21 -48.84 80.04 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.637 0.775 . . . . 0.0 110.364 175.225 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 58.1 mt -63.04 -35.27 70.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 124.108 0.963 . . . . 0.0 111.241 177.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.0 tpt -65.57 -35.7 81.62 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.447 1.099 . . . . 0.0 112.516 173.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 64.0 t -78.35 -47.74 23.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 O-C-N 120.848 -1.158 . . . . 0.0 112.29 175.11 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 18.2 mmtp -80.62 -13.43 59.05 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.52 1.128 . . . . 0.0 112.624 -174.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 51.79 63.95 2.04 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 127.901 2.48 . . . . 0.0 113.434 176.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 37.1 mt -86.6 -11.27 51.93 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.726 0.81 . . . . 0.0 112.729 178.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 45.4 p90 -84.73 154.61 22.33 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.208 1.003 . . . . 0.0 111.632 175.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -88.42 129.15 35.5 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 169.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.75 -31.02 57.97 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 113.876 1.065 . . . . 0.0 113.876 179.23 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -93.91 -17.71 22.71 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.721 1.209 . . . . 0.0 112.702 -172.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -140.84 64.01 1.44 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.837 2.455 . . . . 0.0 109.677 -177.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -62.96 -18.06 62.75 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 -171.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 27.7 p80 -61.1 -32.03 71.71 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.624 0.77 . . . . 0.0 112.761 169.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 7.1 ttm -89.26 136.78 32.83 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.516 1.126 . . . . 0.0 112.021 178.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 3.6 t -122.19 126.58 74.52 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 C-N-CA 125.906 1.682 . . . . 0.0 108.3 172.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -106.22 101.43 10.91 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.396 1.078 . . . . 0.0 109.929 178.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 13.7 m -101.28 9.52 41.66 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.673 0.789 . . . . 0.0 112.976 -179.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.87 -27.92 65.12 Favored Glycine 0 CA--C 1.54 1.646 0 O-C-N 120.912 -1.118 . . . . 0.0 114.169 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -94.13 7.09 72.75 Favored Glycine 0 CA--C 1.541 1.674 0 C-N-CA 125.527 1.537 . . . . 0.0 115.07 171.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -105.97 167.24 9.93 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.109 1.764 . . . . 0.0 112.3 -176.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -46.43 -43.33 16.37 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 126.22 1.808 . . . . 0.0 111.7 169.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 81.0 mt -60.24 -39.86 88.21 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.135 0.574 . . . . 0.0 112.44 176.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -69.65 -37.98 77.55 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 124.573 1.082 . . . . 0.0 113.784 174.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -63.77 -42.73 97.75 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 120.133 1.966 . . . . 0.0 110.897 173.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 29.6 tp -62.06 -49.08 77.42 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 126.096 1.758 . . . . 0.0 112.85 179.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -105.28 -6.85 19.33 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.707 1.203 . . . . 0.0 113.521 -171.105 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 78.66 -30.06 2.0 Favored Glycine 0 CA--C 1.54 1.643 0 O-C-N 120.254 -1.529 . . . . 0.0 113.564 -169.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.94 132.03 9.98 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 127.942 2.497 . . . . 0.0 110.414 176.629 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -144.4 35.03 1.18 Allowed 'General case' 0 N--CA 1.476 0.843 0 CA-C-O 121.901 0.858 . . . . 0.0 110.426 176.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.2 m -99.0 139.37 34.74 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.381 0.673 . . . . 0.0 111.178 179.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 53.9 p90 -163.56 177.24 8.96 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.801 1.24 . . . . 0.0 112.77 -168.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 29.8 t -128.47 141.22 51.46 Favored 'General case' 0 CA--C 1.52 -0.208 0 C-N-CA 124.37 1.068 . . . . 0.0 110.921 168.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 22.7 m -72.25 -9.95 13.45 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 177.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 43.8 pttt -77.11 -10.86 59.66 Favored 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 169.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 44.0 t0 -123.4 77.45 53.9 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 126.431 1.893 . . . . 0.0 109.615 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -70.0 -25.73 27.19 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 123.406 2.737 . . . . 0.0 114.954 -169.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 49.4 m -61.28 -53.47 62.46 Favored Pre-proline 0 N--CA 1.476 0.834 0 CA-C-N 119.867 1.212 . . . . 0.0 114.119 -177.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -66.05 -32.13 44.62 Favored 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.081 1.854 . . . . 0.0 113.011 176.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 39.1 tp -63.4 -51.49 65.57 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.63 1.172 . . . . 0.0 110.079 175.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 68.4 t80 -54.75 -45.92 74.26 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.437 1.095 . . . . 0.0 112.281 171.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -65.27 -35.81 82.17 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 114.077 1.139 . . . . 0.0 114.077 -175.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 55.1 mtm -68.85 -49.78 55.42 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 120.925 0.393 . . . . 0.0 111.401 169.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.2 mp -61.11 -29.59 69.85 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 124.805 1.242 . . . . 0.0 112.463 -179.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 13.7 ttm-85 -52.12 -28.4 17.68 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.701 1.6 . . . . 0.0 113.173 169.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -88.4 -23.41 23.34 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.496 1.518 . . . . 0.0 114.153 173.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 27.0 m120 -123.9 -22.54 4.85 Favored 'General case' 0 N--CA 1.486 1.364 0 N-CA-C 117.141 2.275 . . . . 0.0 117.141 -169.154 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 60.0 tp . . . . . 0 CA--C 1.545 0.756 0 C-N-CA 126.641 1.976 . . . . 0.0 111.588 -169.305 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.8 m . . . . . 0 N--CA 1.479 0.993 0 CA-C-O 120.719 0.295 . . . . 0.0 111.62 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 44.9 ttp180 -104.99 136.74 19.12 Favored Pre-proline 0 N--CA 1.479 0.976 0 C-N-CA 124.711 1.204 . . . . 0.0 110.994 177.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -75.99 177.93 8.1 Favored 'Trans proline' 0 CA--C 1.537 0.629 0 C-N-CA 123.171 2.581 . . . . 0.0 112.331 171.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.5 ttmt -63.0 148.26 48.21 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.686 0.794 . . . . 0.0 110.219 176.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 85.3 mt -58.17 -43.17 98.09 Favored Pre-proline 0 N--CA 1.475 0.811 0 N-CA-C 114.74 1.385 . . . . 0.0 114.74 -169.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -64.45 -27.24 62.48 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 CA-C-N 122.581 1.958 . . . . 0.0 114.04 174.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.9 tt -70.11 -38.84 75.7 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 120.914 -1.116 . . . . 0.0 110.014 171.079 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.9 tp -60.12 -38.63 83.6 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 121.264 -0.898 . . . . 0.0 111.808 170.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.423 ' HA ' ' HE2' ' A' ' 35' ' ' LYS . 8.8 mmpt? -64.05 -40.85 97.19 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.769 0.828 . . . . 0.0 112.429 173.034 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 76.0 mt -62.93 -40.31 88.44 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 124.658 1.183 . . . . 0.0 111.624 175.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 77.6 mt -64.0 -40.71 96.98 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 121.053 -1.03 . . . . 0.0 112.846 170.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 51.4 m170 -60.43 -43.99 96.23 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 119.241 0.928 . . . . 0.0 111.688 171.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -65.64 -25.57 67.42 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.504 1.121 . . . . 0.0 113.059 179.182 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.426 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -73.74 -4.42 34.4 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 123.988 0.915 . . . . 0.0 113.442 172.109 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.35 9.17 65.4 Favored Glycine 0 CA--C 1.536 1.367 0 C-N-CA 125.298 1.428 . . . . 0.0 114.8 -179.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -98.51 144.93 27.3 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.662 1.185 . . . . 0.0 112.277 179.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.6 tp60 -73.77 136.46 43.61 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 121.456 -0.778 . . . . 0.0 109.626 169.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -110.5 93.06 0.71 Allowed Glycine 0 CA--C 1.522 0.517 0 N-CA-C 114.317 0.487 . . . . 0.0 114.317 -172.334 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -146.85 73.64 1.32 Allowed 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.532 1.533 . . . . 0.0 109.939 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 25.7 mtm 65.35 134.31 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 129.77 3.228 . . . . 0.0 117.082 171.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -163.45 163.35 24.89 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 114.052 1.131 . . . . 0.0 114.052 -170.141 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 31.9 p -78.01 170.99 15.68 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.077 1.351 . . . . 0.0 112.458 172.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -53.32 -41.74 45.03 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 O-C-N 121.118 -0.989 . . . . 0.0 111.35 169.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -68.22 -42.95 79.02 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.517 1.127 . . . . 0.0 112.643 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -67.03 -39.28 86.98 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.332 0.653 . . . . 0.0 112.141 177.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 54.5 t -62.44 -46.43 96.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 123.873 0.869 . . . . 0.0 110.838 170.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.78 -37.52 86.55 Favored 'General case' 0 N--CA 1.458 -0.071 0 C-N-CA 126.243 1.817 . . . . 0.0 114.027 -175.178 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 84.4 t60 -51.62 -51.12 58.17 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 122.677 0.391 . . . . 0.0 111.498 172.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 54.5 m-85 -74.74 -33.2 62.31 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 114.522 1.304 . . . . 0.0 114.522 174.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.68 -42.79 77.33 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 120.703 1.592 . . . . 0.0 112.905 178.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.04 -44.0 98.38 Favored Glycine 0 CA--C 1.53 1.008 0 N-CA-C 111.548 -0.621 . . . . 0.0 111.548 173.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.7 tp60 -60.27 -42.05 94.59 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.449 1.099 . . . . 0.0 112.429 172.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.426 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 68.3 t80 -64.6 -51.66 61.57 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.837 1.255 . . . . 0.0 110.718 178.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 59.8 mt -62.09 -37.47 78.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 C-N-CA 123.855 0.862 . . . . 0.0 110.398 178.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -63.58 -47.3 82.07 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.492 1.117 . . . . 0.0 112.748 174.247 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.0 p -78.43 -28.06 14.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 124.111 0.965 . . . . 0.0 113.5 -174.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 20.9 mmtp -95.48 -12.03 26.53 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.317 1.447 . . . . 0.0 113.826 174.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 16.5 mp0 55.37 61.41 2.89 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.612 1.965 . . . . 0.0 113.632 -177.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 40.2 mt -92.77 4.53 53.63 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.543 0.737 . . . . 0.0 112.907 173.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 51.7 p90 -89.46 153.67 20.64 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.362 1.465 . . . . 0.0 110.531 169.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -79.69 122.29 26.37 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.732 -0.605 . . . . 0.0 109.381 169.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 4.6 pm0 -61.86 -34.83 76.7 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.732 1.012 . . . . 0.0 113.732 -174.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -82.86 -25.21 32.79 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.614 0.766 . . . . 0.0 111.799 -175.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -139.98 74.51 1.47 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.998 2.119 . . . . 0.0 110.682 -179.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -58.23 -14.93 8.19 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 114.697 1.369 . . . . 0.0 114.697 -178.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 21.7 p80 -67.8 -1.91 6.25 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 117.995 -1.002 . . . . 0.0 113.668 169.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 14.8 ttm -117.74 140.01 50.27 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.933 1.693 . . . . 0.0 113.284 169.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 54.8 t -115.71 142.42 28.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 127.572 2.349 . . . . 0.0 109.608 169.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -123.04 52.83 1.33 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.287 1.435 . . . . 0.0 112.135 -173.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 67.9 m -75.16 2.41 10.9 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 120.748 -1.22 . . . . 0.0 114.277 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.36 -23.64 54.06 Favored Glycine 0 CA--C 1.539 1.586 0 CA-C-N 120.155 1.343 . . . . 0.0 114.655 173.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -88.34 2.46 85.05 Favored Glycine 0 CA--C 1.54 1.651 0 C-N-CA 124.964 1.269 . . . . 0.0 115.34 171.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -111.56 -174.42 2.46 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 119.158 1.479 . . . . 0.0 113.217 -172.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -63.92 -33.9 76.74 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 120.873 -1.142 . . . . 0.0 111.759 176.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.5 tp -65.22 -38.61 90.96 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-O 121.821 0.819 . . . . 0.0 110.207 173.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -64.02 -40.63 98.37 Favored Glycine 0 CA--C 1.532 1.138 0 C-N-CA 125.074 1.321 . . . . 0.0 113.602 171.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -73.07 -29.42 62.95 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 120.248 2.024 . . . . 0.0 112.009 177.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 23.7 tp -65.57 -50.01 66.73 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.023 1.329 . . . . 0.0 111.65 172.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.45 -5.78 31.74 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 -173.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 77.74 -28.19 1.86 Allowed Glycine 0 CA--C 1.54 1.652 0 C-N-CA 125.502 1.525 . . . . 0.0 113.627 -170.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.3 128.83 9.22 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 127.925 2.49 . . . . 0.0 110.451 175.499 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -140.63 40.57 1.86 Allowed 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.608 1.163 . . . . 0.0 110.072 175.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 10.7 m -103.77 132.22 50.23 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 169.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 40.1 p90 -163.51 169.32 18.94 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.219 1.407 . . . . 0.0 112.384 -167.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 17.2 m -107.64 135.3 49.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 122.396 1.093 . . . . 0.0 110.95 173.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -78.16 -23.4 13.66 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 C-N-CA 125.839 1.656 . . . . 0.0 113.332 -169.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.7 pttt -79.97 -5.28 55.39 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 126.299 1.84 . . . . 0.0 115.333 179.12 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 42.8 t0 -116.21 86.32 17.17 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 126.373 1.869 . . . . 0.0 110.735 -170.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -61.1 -36.94 79.12 Favored 'Trans proline' 0 CA--C 1.537 0.674 0 C-N-CA 124.29 3.327 . . . . 0.0 115.423 -170.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 67.9 m -58.95 -54.91 51.72 Favored Pre-proline 0 N--CA 1.477 0.894 0 CA-C-N 119.848 1.204 . . . . 0.0 114.076 -175.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -70.05 -24.75 27.98 Favored 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 121.956 1.771 . . . . 0.0 112.97 175.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 24.0 tp -67.83 -48.94 64.81 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.323 1.049 . . . . 0.0 110.822 178.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 22.9 m-30 -62.5 -35.71 80.25 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.856 0.862 . . . . 0.0 112.572 177.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -59.88 -42.32 93.52 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.002 0.921 . . . . 0.0 112.735 178.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.424 ' HB2' ' HE2' ' A' ' 101' ' ' MET . 35.4 mtm -72.01 -48.67 43.01 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.795 0.838 . . . . 0.0 112.521 172.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -59.13 -39.59 82.83 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-O 117.793 -1.099 . . . . 0.0 110.974 -175.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 76.6 mtt180 -54.71 -25.48 27.73 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 171.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -87.67 -24.1 24.01 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.437 1.495 . . . . 0.0 114.081 173.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -111.05 -28.38 8.34 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 114.112 1.152 . . . . 0.0 114.112 -170.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 3.2 tt . . . . . 0 CA--C 1.544 0.712 0 C-N-CA 127.587 2.355 . . . . 0.0 108.021 -177.123 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 35.7 m . . . . . 0 N--CA 1.479 0.995 0 CA-C-O 120.854 0.359 . . . . 0.0 111.548 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.8 ttp-105 -93.73 137.15 23.31 Favored Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 125.405 1.482 . . . . 0.0 111.438 178.113 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -75.81 177.98 8.01 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 124.36 3.374 . . . . 0.0 113.843 -178.129 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.9 ttmt -61.82 147.08 47.62 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.366 1.066 . . . . 0.0 110.549 175.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.3 mp -54.07 -48.09 95.16 Favored Pre-proline 0 N--CA 1.472 0.67 0 N-CA-C 115.016 1.487 . . . . 0.0 115.016 -168.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -60.56 -31.26 92.1 Favored 'Trans proline' 0 CA--C 1.537 0.642 0 CA-C-N 122.053 1.769 . . . . 0.0 113.796 177.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 7.5 tt -77.59 -34.7 53.49 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 120.941 -1.1 . . . . 0.0 111.381 177.42 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 45.1 tp -61.36 -38.53 87.28 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.697 -0.627 . . . . 0.0 111.005 169.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -66.57 -35.58 80.56 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.83 0.852 . . . . 0.0 113.042 174.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 93.5 mt -60.55 -45.48 97.08 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 CA-C-N 119.41 1.004 . . . . 0.0 111.061 169.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.1 mp -69.22 -30.79 69.03 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 121.047 -1.033 . . . . 0.0 112.864 177.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 30.1 m170 -67.39 -42.88 82.62 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.188 -0.945 . . . . 0.0 111.557 169.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.23 -25.33 68.02 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.18 0.992 . . . . 0.0 113.117 174.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.411 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -69.62 -9.17 53.06 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 171.282 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 78.65 19.99 72.27 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 125.144 1.354 . . . . 0.0 114.254 -177.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -108.23 7.62 27.47 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 116.048 1.87 . . . . 0.0 116.048 -169.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.427 ' HG2' ' H ' ' A' ' 44' ' ' GLY . 7.3 tt0 48.85 -159.43 0.05 Allowed 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 126.069 1.748 . . . . 0.0 111.211 -169.218 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . 0.427 ' H ' ' HG2' ' A' ' 43' ' ' GLN . . . 165.36 134.66 1.7 Allowed Glycine 0 N--CA 1.469 0.84 0 O-C-N 120.49 -1.381 . . . . 0.0 115.369 169.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -138.67 -19.99 1.03 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.794 1.238 . . . . 0.0 114.143 174.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 3.8 mtm -174.5 131.41 0.36 Allowed 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 128.0 2.52 . . . . 0.0 109.899 -178.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -163.56 152.4 14.08 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 114.569 1.322 . . . . 0.0 114.569 173.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 67.4 p -82.26 174.68 10.94 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 128.153 2.581 . . . . 0.0 112.343 174.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -53.06 -50.37 45.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 CA-C-N 119.908 1.231 . . . . 0.0 109.9 169.046 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 59.1 tptt -55.43 -37.87 68.23 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 119.043 0.838 . . . . 0.0 112.675 -176.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -80.4 -38.85 29.48 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.524 1.13 . . . . 0.0 113.265 175.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 41.9 t -68.11 -50.41 58.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 O-C-N 121.303 -0.873 . . . . 0.0 111.357 -179.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.7 mmm -68.66 -23.91 64.47 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 119.344 0.975 . . . . 0.0 112.642 -173.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -58.9 -55.6 33.07 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.657 0.783 . . . . 0.0 111.303 169.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -74.46 -32.08 62.47 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 177.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.83 -38.57 76.59 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 120.881 -1.137 . . . . 0.0 111.12 174.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.85 -42.05 99.75 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 124.194 0.902 . . . . 0.0 112.41 171.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.8 tp60 -60.37 -43.63 96.37 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.226 1.011 . . . . 0.0 112.11 171.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.411 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 61.6 t80 -60.44 -52.49 64.99 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.838 0.855 . . . . 0.0 110.788 174.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 44.0 mt -60.17 -37.04 71.75 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 124.084 0.954 . . . . 0.0 111.071 179.167 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -64.33 -46.6 82.79 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.372 1.069 . . . . 0.0 112.401 174.17 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.5 p -78.51 -28.52 14.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 N-CA-C 113.66 0.985 . . . . 0.0 113.66 -176.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 57.3 mmtt -91.88 -15.83 27.56 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.148 1.379 . . . . 0.0 113.731 175.038 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 14.1 mp0 54.23 73.26 0.4 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.973 2.109 . . . . 0.0 113.227 -172.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.3 tp -94.62 18.56 11.27 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.892 1.277 . . . . 0.0 112.484 178.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 51.2 p90 -127.53 160.3 31.94 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.628 1.971 . . . . 0.0 111.348 -173.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -81.34 124.74 29.62 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 121.567 -0.708 . . . . 0.0 111.176 172.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.02 -20.19 56.55 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 174.074 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -80.7 -36.69 31.9 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.732 0.813 . . . . 0.0 111.433 -176.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -149.55 92.38 1.92 Allowed 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 127.439 2.296 . . . . 0.0 109.441 -176.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 27.5 mp0 -65.59 -12.41 52.88 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 -169.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 24.3 p80 -66.01 -23.26 66.53 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 170.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 1.9 tpt -81.69 118.84 23.15 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.818 1.647 . . . . 0.0 110.498 175.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 18.2 t -104.14 130.64 54.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 125.904 1.682 . . . . 0.0 108.286 171.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 79.5 t80 -132.45 112.6 12.28 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.227 1.011 . . . . 0.0 109.686 -177.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 23.0 p -76.67 -28.98 56.17 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 114.539 1.311 . . . . 0.0 114.539 -169.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 50.87 -123.84 18.28 Favored Glycine 0 CA--C 1.539 1.567 0 CA-C-N 119.161 0.891 . . . . 0.0 112.136 -173.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -87.77 12.46 63.56 Favored Glycine 0 CA--C 1.542 1.733 0 C-N-CA 125.433 1.492 . . . . 0.0 116.214 176.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -63.12 159.38 17.55 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 119.746 1.773 . . . . 0.0 113.31 -179.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.1 mp -49.17 -37.37 22.18 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.799 1.64 . . . . 0.0 113.465 171.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 89.5 mt -59.76 -44.83 93.67 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 118.911 0.778 . . . . 0.0 111.405 175.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -73.14 -36.73 56.1 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 124.248 0.928 . . . . 0.0 113.099 176.079 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.29 -28.36 66.21 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 119.782 1.791 . . . . 0.0 112.191 178.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 42.9 tp -80.07 -54.53 5.69 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 124.289 1.036 . . . . 0.0 112.71 172.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -88.98 -7.03 56.77 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 123.846 0.858 . . . . 0.0 113.267 -172.095 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.41 -28.61 3.01 Favored Glycine 0 CA--C 1.54 1.605 0 C-N-CA 125.568 1.556 . . . . 0.0 113.001 -169.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.92 139.06 6.09 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 127.67 2.388 . . . . 0.0 111.6 -179.335 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -147.19 54.91 1.09 Allowed 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.904 1.282 . . . . 0.0 109.96 168.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 6.8 m -104.79 130.74 52.83 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-O 121.168 0.509 . . . . 0.0 109.793 169.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 54.4 p90 -168.22 177.04 5.65 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.786 1.634 . . . . 0.0 111.458 -168.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 67.2 p -121.55 143.24 49.4 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 174.205 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 20.5 m -71.28 -15.18 18.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 N-CA-C 113.996 1.11 . . . . 0.0 113.996 -173.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.0 pttt -77.59 -8.12 57.37 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 126.335 1.854 . . . . 0.0 114.419 172.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 44.6 t0 -119.6 78.17 21.0 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 126.142 1.777 . . . . 0.0 110.516 -177.199 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -68.56 -27.61 32.68 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 123.756 2.971 . . . . 0.0 115.288 -169.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 63.7 m -59.35 -54.39 56.62 Favored Pre-proline 0 N--CA 1.478 0.933 0 CA-C-N 120.341 1.428 . . . . 0.0 113.753 -177.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -66.46 -28.9 45.61 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 121.797 1.664 . . . . 0.0 112.585 173.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.97 -52.88 63.84 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.793 1.237 . . . . 0.0 110.631 176.006 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -66.48 -29.28 69.36 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.94 0.896 . . . . 0.0 113.379 174.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -61.76 -50.38 72.61 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.699 1.591 . . . . 0.0 112.377 174.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 36.4 mtm -65.53 -43.08 91.1 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.026 0.53 . . . . 0.0 111.595 175.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 42.8 mt -66.04 -42.27 89.8 Favored 'General case' 0 C--O 1.218 -0.578 0 CA-C-O 117.174 -1.393 . . . . 0.0 112.052 -179.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -56.02 -29.03 59.78 Favored 'General case' 0 N--CA 1.484 1.255 0 CA-C-N 121.347 1.885 . . . . 0.0 113.613 173.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -82.71 -17.6 43.85 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.518 1.527 . . . . 0.0 113.424 175.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -120.87 -15.0 8.41 Favored 'General case' 0 CA--C 1.556 1.196 0 N-CA-C 115.292 1.59 . . . . 0.0 115.292 -172.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 29.6 tp . . . . . 0 CA--C 1.545 0.75 0 C-N-CA 130.484 3.514 . . . . 0.0 108.598 -171.936 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 35.5 m . . . . . 0 N--CA 1.48 1.03 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 84.1 mtm-85 -91.75 138.63 24.92 Favored Pre-proline 0 N--CA 1.479 0.992 0 C-N-CA 124.432 1.093 . . . . 0.0 111.167 176.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -80.92 171.88 13.73 Favored 'Trans proline' 0 CA--C 1.538 0.679 0 C-N-CA 123.986 3.124 . . . . 0.0 113.038 178.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.03 149.43 15.51 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.664 0.786 . . . . 0.0 112.475 173.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 92.5 mt -59.85 -50.03 88.6 Favored Pre-proline 0 N--CA 1.476 0.875 0 N-CA-C 114.099 1.148 . . . . 0.0 114.099 -175.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -67.33 -21.34 47.65 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 121.897 1.731 . . . . 0.0 113.118 174.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.4 tt -69.66 -46.03 67.04 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 118.944 0.793 . . . . 0.0 109.826 170.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.2 tp -60.31 -31.76 70.58 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 120.865 -1.147 . . . . 0.0 112.955 176.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.62 -28.85 68.84 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 121.493 -0.754 . . . . 0.0 112.678 171.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 45.0 mt -71.03 -43.89 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 CA-C-N 119.073 0.851 . . . . 0.0 110.573 173.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.88 -38.94 87.4 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.485 0.714 . . . . 0.0 110.733 175.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 53.3 m170 -66.46 -43.83 84.44 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.426 0.69 . . . . 0.0 112.457 172.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.43 -27.99 69.67 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.945 0.898 . . . . 0.0 113.376 176.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.426 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -72.74 -5.22 36.29 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 124.222 1.009 . . . . 0.0 113.475 172.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.54 9.04 65.18 Favored Glycine 0 CA--C 1.537 1.456 0 C-N-CA 125.422 1.487 . . . . 0.0 115.102 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -97.96 165.67 11.81 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.752 1.221 . . . . 0.0 112.952 179.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 21.7 tm0? -118.03 145.22 44.94 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.65 1.58 . . . . 0.0 109.335 169.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -171.77 158.46 29.34 Favored Glycine 0 N--CA 1.467 0.724 0 N-CA-C 116.287 1.275 . . . . 0.0 116.287 -169.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -140.44 -63.69 0.48 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.987 1.715 . . . . 0.0 109.643 169.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 3.3 mpp? -101.63 141.7 34.1 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 127.14 2.176 . . . . 0.0 112.183 179.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 25.0 m-85 -154.41 159.78 41.28 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.369 1.067 . . . . 0.0 113.678 -175.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 71.3 p -95.21 175.02 6.77 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.353 1.461 . . . . 0.0 108.052 166.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -59.08 -40.18 80.24 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 O-C-N 120.011 -1.681 . . . . 0.0 109.981 169.148 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -59.8 -43.99 94.18 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.768 1.227 . . . . 0.0 112.756 178.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -72.67 -36.74 67.99 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 178.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 75.3 t -65.73 -51.95 56.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 CA-C-N 119.388 0.995 . . . . 0.0 110.669 171.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.4 ppp? -68.88 -26.06 64.93 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -169.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 82.8 t60 -60.18 -53.49 57.09 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 119.101 0.864 . . . . 0.0 111.27 172.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 57.3 m-85 -74.4 -30.38 61.92 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 178.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -68.64 -39.76 80.57 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.326 0.966 . . . . 0.0 112.735 172.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.52 -43.58 97.9 Favored Glycine 0 CA--C 1.532 1.132 0 CA-C-N 118.761 0.71 . . . . 0.0 111.722 172.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 36.1 tp60 -58.67 -45.35 89.61 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.104 0.961 . . . . 0.0 112.156 170.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.426 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 51.7 t80 -60.62 -51.59 68.75 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.708 0.803 . . . . 0.0 110.433 177.784 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 48.7 mt -59.19 -38.87 76.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 124.368 1.067 . . . . 0.0 111.039 178.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.0 tpt -64.57 -45.3 87.62 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.387 1.075 . . . . 0.0 112.726 175.05 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.1 p -78.67 -29.54 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-N 119.703 1.138 . . . . 0.0 113.716 -177.024 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 58.0 mmtt -90.74 -15.91 29.38 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.806 1.242 . . . . 0.0 113.36 175.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 14.1 mp0 50.89 73.73 0.27 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 127.182 2.193 . . . . 0.0 112.856 -172.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 11.8 tp -87.44 -4.45 59.01 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.855 0.862 . . . . 0.0 112.187 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 51.3 p90 -99.18 160.0 14.58 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.53 1.932 . . . . 0.0 111.784 177.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -91.99 134.28 34.95 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 169.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -59.6 -32.21 70.18 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -174.471 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -86.62 -20.49 27.78 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 123.795 0.838 . . . . 0.0 112.578 -169.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -140.37 63.28 1.47 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 127.985 2.514 . . . . 0.0 110.257 -178.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -60.22 -19.77 55.89 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.966 0.906 . . . . 0.0 113.254 -179.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 31.8 p80 -63.09 -7.32 5.35 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.43 1.092 . . . . 0.0 113.889 170.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 39.4 mtp -121.0 149.25 42.95 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.35 1.46 . . . . 0.0 112.926 169.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.9 p -124.1 144.37 34.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 126.075 1.75 . . . . 0.0 109.62 173.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -128.73 110.13 11.92 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.792 1.237 . . . . 0.0 110.586 -170.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 19.8 p -78.61 17.09 0.73 Allowed 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 116.723 2.12 . . . . 0.0 116.723 -168.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -53.57 113.14 2.83 Favored Glycine 0 CA--C 1.537 1.438 0 CA-C-N 119.577 1.08 . . . . 0.0 113.605 -172.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 73.6 9.34 78.28 Favored Glycine 0 CA--C 1.541 1.665 0 C-N-CA 124.979 1.276 . . . . 0.0 115.791 -177.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -86.88 158.67 19.28 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 119.355 1.577 . . . . 0.0 113.531 -175.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 27.9 mt -54.31 -37.22 64.59 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.926 1.29 . . . . 0.0 113.126 169.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.61 -42.34 96.63 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.373 -0.829 . . . . 0.0 111.347 174.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -70.49 -34.01 67.89 Favored Glycine 0 CA--C 1.532 1.109 0 CA-C-O 118.609 -1.106 . . . . 0.0 112.986 175.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -71.62 -29.24 64.45 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 120.218 2.009 . . . . 0.0 111.79 175.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 27.7 tp -71.32 -53.09 15.4 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 124.777 1.231 . . . . 0.0 112.419 174.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -102.49 -9.74 19.97 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.085 1.143 . . . . 0.0 114.085 -169.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.03 -32.89 1.97 Allowed Glycine 0 CA--C 1.54 1.625 0 C-N-CA 124.896 1.236 . . . . 0.0 112.57 -169.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.45 123.19 8.62 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 126.777 2.031 . . . . 0.0 112.553 174.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 -136.86 33.8 2.65 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.595 1.558 . . . . 0.0 111.172 177.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 11.4 m -94.14 132.37 38.74 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 169.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 49.6 p90 -162.35 172.33 15.8 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.335 1.054 . . . . 0.0 112.961 -169.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 81.6 p -116.19 136.42 53.03 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 122.452 1.12 . . . . 0.0 113.586 175.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -78.05 -17.69 13.86 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.442 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 -174.668 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.5 pttt -72.8 -8.47 55.63 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.666 1.586 . . . . 0.0 114.637 175.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -120.57 83.36 34.58 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 126.386 1.875 . . . . 0.0 110.147 -177.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -68.12 -25.2 37.74 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.862 3.041 . . . . 0.0 115.224 -169.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 62.5 m -63.52 -54.89 39.55 Favored Pre-proline 0 N--CA 1.476 0.875 0 CA-C-N 119.813 1.188 . . . . 0.0 113.87 -178.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -65.5 -30.38 52.37 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 121.827 1.685 . . . . 0.0 112.553 175.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 22.4 tp -62.61 -47.95 81.54 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.983 0.913 . . . . 0.0 111.11 174.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -59.99 -37.98 81.27 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 121.489 -0.757 . . . . 0.0 112.179 173.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -64.28 -47.26 80.22 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.043 0.937 . . . . 0.0 112.939 176.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.453 ' HB2' ' HE2' ' A' ' 101' ' ' MET . 3.9 mtp -56.9 -44.46 82.38 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.335 1.054 . . . . 0.0 112.111 172.293 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.1 mp -62.53 -47.17 85.06 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.392 1.077 . . . . 0.0 110.567 176.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 14.8 mtt180 -56.98 -21.64 31.96 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.68 1.192 . . . . 0.0 114.142 171.011 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -98.57 -5.17 32.54 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 126.396 1.878 . . . . 0.0 115.01 175.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 18.9 p30 -115.88 -27.6 6.95 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 120.349 1.432 . . . . 0.0 114.479 175.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 39.8 tp . . . . . 0 CA--C 1.548 0.874 0 C-N-CA 126.565 1.946 . . . . 0.0 111.905 175.801 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 33.5 m . . . . . 0 N--CA 1.48 1.036 0 CA-C-O 121.055 0.455 . . . . 0.0 111.706 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.7 ttp-105 -87.11 133.04 39.83 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 124.693 1.197 . . . . 0.0 111.721 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -73.19 175.8 10.04 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 123.586 2.857 . . . . 0.0 112.228 173.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.5 tpmt? -61.52 147.31 45.82 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.472 0.709 . . . . 0.0 110.605 177.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -59.32 -40.63 82.05 Favored Pre-proline 0 N--CA 1.473 0.714 0 CA-C-O 117.32 -1.324 . . . . 0.0 114.239 -170.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -61.06 -33.85 91.06 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 121.994 1.796 . . . . 0.0 113.696 173.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.2 tt -70.12 -40.75 74.7 Favored 'General case' 0 CA--C 1.546 0.804 0 O-C-N 121.469 -0.769 . . . . 0.0 109.666 175.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.8 tt -63.91 -35.4 80.54 Favored 'General case' 0 N--CA 1.475 0.825 0 O-C-N 120.858 -1.151 . . . . 0.0 112.791 172.367 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.66 -38.91 92.15 Favored 'General case' 0 N--CA 1.48 1.026 0 O-C-N 121.216 -0.928 . . . . 0.0 112.223 170.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 91.8 mt -67.06 -38.33 81.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 123.676 0.79 . . . . 0.0 111.636 174.065 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 77.0 mt -61.99 -40.73 96.63 Favored 'General case' 0 CA--C 1.544 0.75 0 O-C-N 121.107 -0.996 . . . . 0.0 112.142 170.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 34.8 m170 -62.22 -42.95 99.77 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 119.332 0.969 . . . . 0.0 112.293 170.03 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.25 -25.43 68.05 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 177.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.56 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -72.91 -7.37 50.66 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 172.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 89.4 6.35 71.02 Favored Glycine 0 CA--C 1.537 1.449 0 C-N-CA 125.228 1.394 . . . . 0.0 114.584 -175.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -87.71 177.86 6.91 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.706 1.202 . . . . 0.0 112.263 175.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.96 149.3 43.12 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.257 1.423 . . . . 0.0 109.942 172.339 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 176.12 161.68 25.68 Favored Glycine 0 CA--C 1.527 0.802 0 N-CA-C 116.791 1.476 . . . . 0.0 116.791 170.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -125.65 8.52 7.62 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 126.018 1.727 . . . . 0.0 112.444 171.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.1 mtm -170.95 135.36 1.03 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 128.888 2.875 . . . . 0.0 109.055 -177.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -149.27 144.39 26.47 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -176.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 46.6 p -86.59 169.47 12.73 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.471 1.108 . . . . 0.0 111.304 168.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.1 t -56.16 -46.18 81.06 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 O-C-N 120.661 -1.274 . . . . 0.0 109.943 169.338 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -56.59 -35.93 68.8 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.721 0.808 . . . . 0.0 113.074 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -77.32 -46.16 23.82 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 173.195 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 74.8 t -63.93 -49.45 81.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 O-C-N 121.451 -0.781 . . . . 0.0 111.756 -177.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -71.24 -27.28 63.36 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 119.89 1.223 . . . . 0.0 112.287 -172.261 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -58.81 -54.45 46.95 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.345 0.658 . . . . 0.0 111.118 170.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -74.35 -32.29 62.73 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 178.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -68.05 -41.98 81.19 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 119.996 1.271 . . . . 0.0 111.823 173.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -61.36 -47.28 91.67 Favored Glycine 0 CA--C 1.527 0.81 0 CA-C-N 119.018 0.826 . . . . 0.0 111.624 173.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.3 tp60 -55.97 -47.9 76.8 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.384 1.073 . . . . 0.0 112.094 172.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.56 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 47.9 t80 -60.36 -48.79 80.25 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.121 0.968 . . . . 0.0 110.894 177.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 58.3 mt -60.85 -36.93 74.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 125.21 1.404 . . . . 0.0 111.148 178.244 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 35.3 mmt -66.34 -38.52 87.83 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.551 1.068 . . . . 0.0 113.051 171.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 82.2 t -78.31 -32.21 16.66 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 CA-C-N 119.217 0.917 . . . . 0.0 112.906 -178.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 47.2 mmtt -91.47 -15.54 28.67 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.159 1.383 . . . . 0.0 113.0 177.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.5 mp0 52.3 63.98 2.03 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.344 1.857 . . . . 0.0 113.038 -173.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 89.5 mt -92.46 18.95 7.74 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 124.432 1.093 . . . . 0.0 112.146 176.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 36.0 p90 -124.33 158.49 32.49 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 126.517 1.927 . . . . 0.0 111.005 -177.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -87.08 128.43 35.1 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.791 -0.568 . . . . 0.0 111.175 172.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -61.51 -20.72 63.52 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 172.059 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -81.78 -36.56 28.32 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.055 0.942 . . . . 0.0 111.291 -177.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -148.24 85.02 1.51 Allowed 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 127.321 2.248 . . . . 0.0 109.867 -173.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 28.3 mp0 -62.5 -15.64 51.28 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -172.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 27.3 p80 -65.88 -23.74 66.71 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 172.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.2 tpt -81.77 128.66 34.23 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.536 1.534 . . . . 0.0 110.758 175.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 3.9 t -126.16 112.39 29.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 C-N-CA 125.48 1.512 . . . . 0.0 109.4 179.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 35.9 t80 -95.46 52.25 1.37 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.875 1.27 . . . . 0.0 112.09 -170.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 55.6 m -69.69 -5.39 24.65 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 179.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.63 -25.12 58.04 Favored Glycine 0 CA--C 1.541 1.704 0 CA-C-N 120.116 1.326 . . . . 0.0 113.524 169.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -88.81 2.83 84.66 Favored Glycine 0 CA--C 1.542 1.728 0 C-N-CA 125.392 1.472 . . . . 0.0 115.295 171.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -108.93 172.99 6.52 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.174 1.79 . . . . 0.0 112.552 -177.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.8 tp -46.57 -43.05 16.84 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 126.809 2.044 . . . . 0.0 112.11 169.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 67.4 mt -54.79 -43.14 72.6 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-O 122.113 0.959 . . . . 0.0 112.159 173.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -74.64 -32.24 57.63 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 125.95 1.738 . . . . 0.0 114.412 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -67.25 -42.66 83.57 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 120.109 1.955 . . . . 0.0 110.374 169.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 24.9 tp -59.64 -50.95 71.88 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.413 1.485 . . . . 0.0 111.903 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -96.58 -13.8 22.67 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 -178.591 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.77 -18.24 12.85 Favored Glycine 0 CA--C 1.541 1.688 0 C-N-CA 125.641 1.591 . . . . 0.0 115.825 -178.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.41 17.99 1.52 Allowed 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 115.934 1.827 . . . . 0.0 115.934 -176.697 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.7 tp60 -68.05 40.73 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.045 0 N-CA-C 118.011 2.597 . . . . 0.0 118.011 -167.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 72.4 m -97.71 144.01 27.78 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 120.419 -1.426 . . . . 0.0 109.202 168.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 55.0 p90 -159.5 162.98 35.62 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -169.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 13.8 m -125.43 136.55 53.51 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.394 1.078 . . . . 0.0 110.679 177.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 20.1 m -77.42 -11.38 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -170.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -78.04 -13.88 59.71 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.875 1.27 . . . . 0.0 113.498 178.017 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -120.56 81.22 31.64 Favored Pre-proline 0 CA--C 1.547 0.86 0 C-N-CA 127.916 2.486 . . . . 0.0 108.874 179.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.18 -27.51 16.67 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 123.502 2.801 . . . . 0.0 114.739 -169.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 45.6 m -57.28 -51.06 84.54 Favored Pre-proline 0 N--CA 1.478 0.938 0 CA-C-N 120.342 1.428 . . . . 0.0 114.21 -178.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -67.49 -27.45 39.5 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 121.901 1.734 . . . . 0.0 113.38 175.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 21.8 tp -68.81 -42.45 77.26 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.292 1.037 . . . . 0.0 110.957 174.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -61.55 -33.79 74.45 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 118.126 -0.94 . . . . 0.0 112.675 172.395 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -62.96 -47.07 84.77 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 120.408 1.458 . . . . 0.0 112.377 176.384 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.432 ' HB2' ' HE2' ' A' ' 101' ' ' MET . 5.7 mtm -58.78 -47.43 84.75 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.023 0.929 . . . . 0.0 111.631 172.488 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.8 mp -67.06 -38.75 86.36 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 118.033 -0.984 . . . . 0.0 112.305 -179.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 7.6 mpt_? -56.04 -24.99 42.98 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-N 120.539 1.518 . . . . 0.0 113.345 171.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -93.07 -13.62 28.35 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.057 1.743 . . . . 0.0 114.076 176.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 21.6 t30 -131.89 -20.06 2.54 Favored 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 116.579 2.066 . . . . 0.0 116.579 -173.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 48.3 tp . . . . . 0 CA--C 1.547 0.838 0 C-N-CA 126.498 1.919 . . . . 0.0 114.693 -169.079 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 18.9 m . . . . . 0 N--CA 1.481 1.103 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.3 ttp180 -90.76 130.21 41.73 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 124.876 1.27 . . . . 0.0 112.258 -174.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -70.38 176.51 7.14 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 124.09 3.194 . . . . 0.0 112.872 169.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -58.8 144.17 44.93 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.871 0.868 . . . . 0.0 109.786 173.283 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 86.1 mt -63.43 -38.6 41.2 Favored Pre-proline 0 N--CA 1.476 0.856 0 N-CA-C 114.697 1.369 . . . . 0.0 114.697 -169.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -62.98 -33.34 74.75 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 121.686 1.591 . . . . 0.0 113.217 170.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 8.8 tt -68.97 -45.19 71.29 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.387 0.994 . . . . 0.0 111.048 176.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.4 tt -52.33 -38.99 60.07 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.97 0.908 . . . . 0.0 111.333 169.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.59 -28.06 68.86 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.893 1.071 . . . . 0.0 113.893 176.44 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 65.2 mt -68.63 -40.41 81.73 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 CA-C-N 119.362 0.983 . . . . 0.0 110.648 171.122 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.7 mp -64.96 -37.6 88.17 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.144 -0.972 . . . . 0.0 111.005 173.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 17.9 m170 -64.09 -40.01 95.3 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.63 -0.669 . . . . 0.0 111.771 172.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.87 -29.34 70.54 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.991 0.917 . . . . 0.0 113.01 173.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.404 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -73.28 -2.49 22.19 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.227 1.011 . . . . 0.0 113.488 171.334 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.93 7.31 64.47 Favored Glycine 0 CA--C 1.536 1.361 0 C-N-CA 125.729 1.633 . . . . 0.0 114.978 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -106.56 109.45 21.37 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 118.777 1.289 . . . . 0.0 112.282 -175.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.8 tm0? -69.84 141.82 53.18 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.22 0.608 . . . . 0.0 110.149 170.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 172.01 168.17 33.13 Favored Glycine 0 N--CA 1.466 0.695 0 C-N-CA 123.595 0.617 . . . . 0.0 114.478 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -128.08 -57.91 1.23 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.389 1.476 . . . . 0.0 111.293 179.18 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 24.0 mtm -106.06 125.71 51.32 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.846 1.658 . . . . 0.0 111.876 -177.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -139.21 145.23 39.02 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.256 1.022 . . . . 0.0 113.417 -173.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 52.9 p -88.38 174.66 8.02 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 125.482 1.513 . . . . 0.0 111.848 169.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 2.6 t -56.25 -46.03 81.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 120.441 -1.412 . . . . 0.0 109.837 168.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 63.4 tttm -58.75 -40.49 84.0 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.871 0.868 . . . . 0.0 112.423 -179.154 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -74.98 -36.41 62.02 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 175.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 67.6 t -67.36 -58.35 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 CA-C-O 117.78 -1.105 . . . . 0.0 110.998 176.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 16.1 mmt -60.59 -30.53 69.87 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-N 120.744 1.611 . . . . 0.0 112.889 -173.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -54.49 -59.09 5.15 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.704 173.323 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -74.72 -32.85 62.25 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 175.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.85 -40.67 60.87 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 120.801 -1.187 . . . . 0.0 112.043 -177.328 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.48 -40.69 99.05 Favored Glycine 0 CA--C 1.529 0.913 0 N-CA-C 111.604 -0.598 . . . . 0.0 111.604 171.494 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.8 tp60 -60.65 -45.01 95.71 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.13 0.972 . . . . 0.0 112.07 171.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.404 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 46.4 t80 -60.42 -51.6 68.81 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.347 1.059 . . . . 0.0 110.488 176.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 45.8 mt -61.58 -37.58 78.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 C-N-CA 124.024 0.929 . . . . 0.0 110.626 179.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -67.5 -42.28 83.1 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 119.425 1.011 . . . . 0.0 113.292 175.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.8 p -78.54 -30.08 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -177.218 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 21.9 mmtp -97.2 -12.4 23.07 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 125.112 1.365 . . . . 0.0 113.889 177.067 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.0 mp0 51.82 78.4 0.12 Allowed 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 126.95 2.1 . . . . 0.0 114.343 -176.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.6 tp -95.11 2.12 55.07 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.403 1.081 . . . . 0.0 112.884 177.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -102.04 162.17 13.12 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 127.627 2.371 . . . . 0.0 110.981 174.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -92.34 132.63 36.57 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 168.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.98 -29.02 64.91 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.165 0.893 . . . . 0.0 113.101 -176.627 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -78.34 -25.59 46.46 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.466 1.106 . . . . 0.0 111.862 -174.567 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -143.96 63.7 1.33 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 127.411 2.284 . . . . 0.0 110.127 -169.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -60.55 -20.0 59.03 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.823 0.849 . . . . 0.0 113.178 179.314 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 6.1 p-80 -66.28 -7.4 18.41 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.195 1.398 . . . . 0.0 113.867 169.411 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.6 ttm -124.95 143.48 50.86 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.438 1.895 . . . . 0.0 111.846 174.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.0 t -129.17 141.31 46.93 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 126.535 1.934 . . . . 0.0 108.878 -174.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -122.85 71.34 1.04 Allowed 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.582 1.153 . . . . 0.0 111.394 -171.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 3.5 m -87.71 8.1 27.08 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.185 1.18 . . . . 0.0 114.185 -173.092 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.42 -27.38 63.22 Favored Glycine 0 CA--C 1.54 1.6 0 O-C-N 120.852 -1.155 . . . . 0.0 114.64 179.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -89.43 3.89 83.91 Favored Glycine 0 CA--C 1.54 1.617 0 C-N-CA 125.186 1.374 . . . . 0.0 115.172 172.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -109.28 173.22 6.42 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.97 1.708 . . . . 0.0 112.508 -175.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.1 mp -53.17 -32.93 50.37 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.765 1.626 . . . . 0.0 113.041 169.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 95.8 mt -61.08 -47.51 85.99 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.102 -0.999 . . . . 0.0 111.397 170.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -63.61 -38.28 96.02 Favored Glycine 0 CA--C 1.531 1.053 0 CA-C-O 119.064 -0.853 . . . . 0.0 113.031 173.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.16 -29.24 62.71 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 119.903 1.851 . . . . 0.0 112.951 179.676 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.4 pp -80.66 -35.19 34.17 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 175.185 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.08 -7.49 23.16 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 119.266 0.939 . . . . 0.0 113.517 -177.817 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.08 -27.04 3.16 Favored Glycine 0 CA--C 1.541 1.659 0 O-C-N 120.164 -1.585 . . . . 0.0 113.35 -169.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.27 137.47 7.12 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 128.092 2.557 . . . . 0.0 110.789 177.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -144.75 56.36 1.27 Allowed 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 119.003 0.82 . . . . 0.0 110.608 169.331 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 6.7 m -102.78 129.24 49.37 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 168.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 52.3 p90 -163.4 173.8 12.75 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.693 1.197 . . . . 0.0 112.857 -168.057 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 52.9 p -119.97 146.14 46.11 Favored 'General case' 0 C--N 1.333 -0.139 0 C-N-CA 123.87 0.868 . . . . 0.0 112.984 172.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 14.4 m -77.68 -14.02 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 C-N-CA 123.157 0.583 . . . . 0.0 112.435 169.562 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 22.6 ttpp -64.73 -28.61 69.7 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.357 1.863 . . . . 0.0 112.598 169.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -117.55 77.47 10.72 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 126.46 1.904 . . . . 0.0 110.003 177.044 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -69.78 -24.78 29.18 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 123.613 2.875 . . . . 0.0 115.023 -169.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 48.8 m -60.4 -52.75 70.73 Favored Pre-proline 0 N--CA 1.477 0.886 0 CA-C-N 120.11 1.323 . . . . 0.0 114.124 -177.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -64.54 -32.33 59.18 Favored 'Trans proline' 0 CA--C 1.539 0.765 0 C-N-CA 122.109 1.872 . . . . 0.0 113.081 175.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 19.6 tp -65.38 -43.39 90.86 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 121.247 -0.908 . . . . 0.0 111.046 173.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -63.85 -37.4 87.26 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.745 0.818 . . . . 0.0 112.223 174.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -62.71 -47.51 83.28 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.836 0.854 . . . . 0.0 112.655 174.419 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.445 ' HB2' ' HE3' ' A' ' 101' ' ' MET . 32.0 mtm -58.99 -46.72 87.44 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.211 0.604 . . . . 0.0 112.223 171.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 59.0 mt -58.55 -47.18 85.07 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.064 0.946 . . . . 0.0 111.821 177.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 34.9 mtp180 -54.46 -25.11 23.22 Favored 'General case' 0 N--CA 1.482 1.168 0 CA-C-N 119.768 1.167 . . . . 0.0 113.535 173.059 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -91.55 -15.41 28.74 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 126.259 1.823 . . . . 0.0 114.655 176.331 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 14.6 p30 -116.29 -23.14 8.5 Favored 'General case' 0 N--CA 1.483 1.225 0 CA-C-N 120.485 1.493 . . . . 0.0 114.587 179.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 30.0 tp . . . . . 0 CA--C 1.537 0.45 0 C-N-CA 128.405 2.682 . . . . 0.0 106.101 169.624 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 31.7 m . . . . . 0 N--CA 1.482 1.138 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 95.4 mtm-85 -86.18 149.42 49.88 Favored Pre-proline 0 N--CA 1.48 1.037 0 O-C-N 121.004 -1.06 . . . . 0.0 111.217 -177.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -73.19 174.65 11.71 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 123.155 2.57 . . . . 0.0 111.823 169.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt -62.94 148.46 47.4 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.406 1.082 . . . . 0.0 110.054 177.112 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 94.0 mt -55.74 -46.73 99.7 Favored Pre-proline 0 N--CA 1.476 0.832 0 N-CA-C 115.24 1.57 . . . . 0.0 115.24 -168.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -66.4 -23.54 50.95 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 CA-C-N 122.509 1.932 . . . . 0.0 114.247 175.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.3 tt -71.78 -39.97 69.57 Favored 'General case' 0 N--CA 1.474 0.725 0 O-C-N 120.85 -1.156 . . . . 0.0 109.932 170.01 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 13.6 tp -61.58 -34.58 75.86 Favored 'General case' 0 CA--C 1.548 0.895 0 O-C-N 121.12 -0.987 . . . . 0.0 111.665 170.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.419 ' HA ' ' HE2' ' A' ' 35' ' ' LYS . 8.5 mmpt? -65.43 -39.34 91.97 Favored 'General case' 0 N--CA 1.481 1.095 0 O-C-N 121.147 -0.971 . . . . 0.0 112.649 170.012 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 52.6 mt -63.57 -38.88 83.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 124.401 1.08 . . . . 0.0 111.844 172.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.9 mt -61.52 -41.04 96.72 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 121.058 -1.026 . . . . 0.0 112.235 169.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 49.4 m170 -64.68 -41.93 95.7 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 121.494 -0.754 . . . . 0.0 112.209 172.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.91 -25.0 67.7 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.774 1.23 . . . . 0.0 113.331 177.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.424 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -71.44 -6.5 40.84 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.904 0.881 . . . . 0.0 113.313 171.684 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.03 12.73 59.9 Favored Glycine 0 CA--C 1.536 1.388 0 C-N-CA 125.177 1.37 . . . . 0.0 114.453 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -108.92 163.16 13.53 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.533 1.533 . . . . 0.0 112.813 -178.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -79.99 172.54 13.63 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 121.63 -0.669 . . . . 0.0 110.934 168.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -153.44 102.44 0.22 Allowed Glycine 0 N--CA 1.469 0.841 0 O-C-N 121.373 -0.829 . . . . 0.0 114.252 177.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -150.12 85.62 1.41 Allowed 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 126.805 2.042 . . . . 0.0 107.384 170.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.1 mpp? 67.22 135.46 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 131.49 3.916 . . . . 0.0 116.256 176.751 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -161.76 169.34 21.59 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.138 1.375 . . . . 0.0 112.788 177.309 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 82.1 p -91.09 171.65 9.11 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 126.55 1.94 . . . . 0.0 111.954 172.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -51.19 -42.23 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.317 0 O-C-N 121.288 -0.883 . . . . 0.0 111.537 172.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -62.57 -48.19 80.53 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.367 1.067 . . . . 0.0 112.544 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -73.64 -31.56 63.57 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -178.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 57.9 t -64.91 -46.31 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 O-C-N 121.615 -0.678 . . . . 0.0 110.647 169.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.9 ttm -69.29 -32.67 71.98 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 126.2 1.8 . . . . 0.0 114.114 -177.345 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -51.48 -49.7 61.3 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 122.974 0.51 . . . . 0.0 111.137 169.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 42.3 m-85 -74.71 -36.7 62.69 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 115.04 1.496 . . . . 0.0 115.04 171.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.1 mp -71.77 -36.95 70.52 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 120.87 1.668 . . . . 0.0 113.435 -177.42 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.13 -42.1 99.56 Favored Glycine 0 CA--C 1.533 1.18 0 CA-C-N 119.246 0.93 . . . . 0.0 111.688 170.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.9 tp60 -62.14 -42.69 99.5 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.644 1.178 . . . . 0.0 112.317 172.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.424 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 50.4 t80 -62.17 -52.34 64.2 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.743 1.217 . . . . 0.0 110.2 176.432 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 69.0 mt -58.68 -39.61 76.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 C-N-CA 123.954 0.902 . . . . 0.0 110.752 178.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.3 tpt -65.8 -44.19 86.41 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.351 1.06 . . . . 0.0 112.902 175.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.0 p -78.49 -27.77 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 CA-C-N 119.809 1.186 . . . . 0.0 113.399 -177.472 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 54.4 mmtt -89.73 -15.74 31.83 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.108 1.363 . . . . 0.0 113.268 173.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 13.9 mp0 51.86 57.88 6.05 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.815 2.046 . . . . 0.0 112.268 -171.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 13.8 tp -91.88 0.93 57.46 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.393 1.077 . . . . 0.0 112.533 -174.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 41.5 p90 -92.62 156.43 17.1 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.854 1.662 . . . . 0.0 111.177 171.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -80.41 122.71 27.3 Favored 'General case' 0 CA--C 1.541 0.634 0 O-C-N 121.579 -0.7 . . . . 0.0 110.86 172.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -59.53 -23.85 63.18 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 114.683 1.364 . . . . 0.0 114.683 177.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -91.35 -27.81 18.12 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 123.96 0.904 . . . . 0.0 112.154 -173.443 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -147.03 87.73 1.7 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.844 2.457 . . . . 0.0 109.605 178.328 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 29.6 mp0 -64.43 -12.03 39.22 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 -169.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 28.1 p80 -65.66 -24.79 67.11 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 170.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 20.6 tpp -86.14 132.02 34.12 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.239 1.416 . . . . 0.0 111.629 177.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 3.7 t -127.09 125.71 66.85 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 C-N-CA 127.01 2.124 . . . . 0.0 109.49 178.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 23.2 t80 -101.14 46.84 0.93 Allowed 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.64 1.176 . . . . 0.0 113.244 -169.626 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 85.2 m -64.88 -9.65 22.58 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 120.467 -1.396 . . . . 0.0 113.848 -179.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -54.98 -22.79 29.13 Favored Glycine 0 CA--C 1.541 1.687 0 C-N-CA 124.78 1.181 . . . . 0.0 113.776 169.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -86.72 1.98 87.15 Favored Glycine 0 CA--C 1.541 1.71 0 C-N-CA 125.228 1.394 . . . . 0.0 116.148 173.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -131.69 -173.62 3.18 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 120.1 1.95 . . . . 0.0 113.769 -175.217 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 7.5 mp -47.15 -40.52 15.89 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.949 1.699 . . . . 0.0 113.532 179.081 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.5 tp -68.57 -32.4 72.29 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-O 121.617 0.722 . . . . 0.0 111.256 178.625 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -73.15 -36.0 56.74 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 126.64 2.067 . . . . 0.0 114.51 173.442 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -66.37 -42.36 88.09 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.861 1.83 . . . . 0.0 110.161 170.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 27.7 tp -59.25 -51.45 69.93 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.677 1.191 . . . . 0.0 112.332 178.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.22 -10.98 26.74 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 114.91 1.448 . . . . 0.0 114.91 -177.303 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.0 -20.04 7.06 Favored Glycine 0 CA--C 1.539 1.584 0 C-N-CA 125.931 1.729 . . . . 0.0 115.638 -179.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.09 30.57 0.49 Allowed 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -175.207 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 5.6 tp60 -70.45 44.79 0.08 Allowed 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 116.4 2.0 . . . . 0.0 116.4 -168.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 21.2 m -105.61 138.36 41.94 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 120.778 -1.201 . . . . 0.0 108.973 169.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 45.7 p90 -157.24 167.94 28.87 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 -167.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 50.1 m -115.09 136.02 53.57 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 113.936 -1.484 . . . . 0.0 109.841 175.3 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 24.4 m -77.53 -20.05 14.05 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.344 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -178.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -74.8 -6.25 47.94 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 126.484 1.913 . . . . 0.0 115.171 -178.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -121.16 87.89 44.66 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 126.439 1.896 . . . . 0.0 109.476 -177.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -63.33 -31.34 73.35 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 123.93 3.086 . . . . 0.0 115.273 -169.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 70.0 m -61.5 -55.91 38.34 Favored Pre-proline 0 N--CA 1.477 0.89 0 CA-C-N 120.12 1.327 . . . . 0.0 113.825 -177.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -67.17 -27.17 41.81 Favored 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 121.817 1.678 . . . . 0.0 112.63 175.219 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 27.9 tp -65.55 -45.93 81.5 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.634 0.774 . . . . 0.0 111.158 175.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -63.48 -36.33 83.4 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.627 -0.671 . . . . 0.0 112.564 173.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -59.92 -46.3 89.8 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 119.355 0.98 . . . . 0.0 112.079 176.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.403 ' HE3' ' HB2' ' A' ' 101' ' ' MET . 29.0 mtm -62.09 -49.86 74.25 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 171.637 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -64.94 -46.76 80.23 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 118.042 -0.98 . . . . 0.0 111.053 -171.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -58.19 -23.6 56.11 Favored 'General case' 0 N--CA 1.482 1.14 0 CA-C-N 119.975 1.261 . . . . 0.0 113.338 175.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -90.49 -18.74 24.78 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.968 1.707 . . . . 0.0 114.806 174.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -121.86 -26.68 4.78 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-N 119.843 1.201 . . . . 0.0 114.145 -171.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 3.3 tt . . . . . 0 CA--C 1.543 0.676 0 C-N-CA 127.631 2.373 . . . . 0.0 107.188 174.703 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 17.8 m . . . . . 0 N--CA 1.481 1.093 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 30.9 ttm105 -86.69 143.1 35.26 Favored Pre-proline 0 N--CA 1.48 1.075 0 C-N-CA 124.796 1.238 . . . . 0.0 112.56 -172.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -65.81 166.83 19.09 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 122.606 2.204 . . . . 0.0 111.953 168.33 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 27.8 ttpt -72.53 157.67 37.15 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 170.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.3 mp -50.4 -47.5 83.27 Favored Pre-proline 0 N--CA 1.473 0.696 0 N-CA-C 115.252 1.575 . . . . 0.0 115.252 -168.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_exo -66.19 -28.99 47.79 Favored 'Trans proline' 0 C--N 1.348 0.522 0 CA-C-N 121.689 1.639 . . . . 0.0 113.732 178.414 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.4 tt -74.11 -38.62 63.77 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.37 -0.831 . . . . 0.0 109.606 177.266 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 23.1 tp -60.2 -35.59 75.75 Favored 'General case' 0 CA--C 1.55 0.956 0 O-C-N 121.521 -0.737 . . . . 0.0 111.341 170.115 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.4 mmtp -69.62 -36.51 76.21 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 121.386 -0.821 . . . . 0.0 112.552 174.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.29 -38.65 81.66 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.495 0.718 . . . . 0.0 110.921 170.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.5 mp -64.13 -39.95 95.14 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.029 -1.045 . . . . 0.0 113.116 171.155 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 35.6 m170 -58.81 -47.32 85.17 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 119.592 1.087 . . . . 0.0 111.497 170.087 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.16 -25.15 68.22 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 177.098 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.469 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -67.62 -15.22 63.54 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.067 0.947 . . . . 0.0 113.322 172.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 89.47 12.59 62.68 Favored Glycine 0 CA--C 1.537 1.413 0 C-N-CA 125.06 1.314 . . . . 0.0 113.883 -169.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -98.67 157.5 16.22 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.893 1.277 . . . . 0.0 111.662 176.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.8 tp60 -80.38 164.42 23.11 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.658 0.783 . . . . 0.0 111.36 174.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -82.08 -156.78 18.86 Favored Glycine 0 CA--C 1.537 1.462 0 N-CA-C 115.809 1.084 . . . . 0.0 115.809 174.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 61.0 66.16 0.93 Allowed 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 127.611 2.364 . . . . 0.0 116.592 173.39 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . 0.401 0.9 OUTLIER 51.38 146.05 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.275 1 N-CA-C 121.967 4.062 . . . . 0.0 121.967 168.307 . . . . . . . . 4 3 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -157.53 172.15 19.08 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.559 1.543 . . . . 0.0 112.596 -168.416 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 40.0 p -81.66 168.78 17.77 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 124.475 1.11 . . . . 0.0 112.067 171.058 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -57.92 -41.06 79.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 120.22 -1.55 . . . . 0.0 110.663 172.406 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -59.42 -31.77 69.58 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.666 0.786 . . . . 0.0 112.709 178.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -80.55 -53.16 6.81 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.082 0.953 . . . . 0.0 112.903 170.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 88.5 t -56.08 -52.3 51.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 123.776 0.83 . . . . 0.0 111.275 -176.42 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 26.7 mmm -73.15 -30.64 63.73 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -172.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 54.9 t-80 -61.58 -48.24 81.83 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.583 170.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -64.54 -38.95 92.79 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 121.743 -0.598 . . . . 0.0 112.389 173.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.98 -38.78 92.11 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 121.187 -0.946 . . . . 0.0 111.448 175.055 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.74 -39.14 97.17 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 125.385 1.469 . . . . 0.0 112.885 172.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 11.9 tp60 -60.94 -48.64 80.87 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.757 1.223 . . . . 0.0 111.091 169.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.469 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 33.5 t80 -56.54 -48.96 76.17 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.122 -0.986 . . . . 0.0 110.735 174.218 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 47.0 mt -59.63 -36.76 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 125.228 1.411 . . . . 0.0 111.935 177.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.5 tpt -68.12 -36.5 79.84 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.718 1.207 . . . . 0.0 112.231 174.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 94.2 t -78.18 -33.41 17.84 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 124.063 0.945 . . . . 0.0 112.677 178.458 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 48.2 mmtt -89.84 -14.82 33.56 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.752 1.221 . . . . 0.0 113.222 178.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.6 mp0 50.02 63.94 1.99 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 127.627 2.371 . . . . 0.0 113.088 -171.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 14.3 tp -91.26 -1.59 57.64 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.149 0.98 . . . . 0.0 113.295 -175.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 55.1 p90 -90.25 156.22 18.45 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.551 1.54 . . . . 0.0 111.923 178.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -76.83 128.64 34.97 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.816 -0.553 . . . . 0.0 111.136 171.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.6 pm0 -69.68 -27.22 64.83 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 115.271 1.582 . . . . 0.0 115.271 -171.171 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -96.08 -26.92 15.32 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 119.165 0.893 . . . . 0.0 111.891 -177.315 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -136.19 79.75 1.79 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.669 1.988 . . . . 0.0 111.178 176.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 29.7 mp0 -60.89 -12.73 12.0 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -173.428 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 23.9 p80 -62.38 -25.76 68.1 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 118.94 0.791 . . . . 0.0 112.786 170.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 18.2 tpp -83.6 129.17 34.96 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.069 1.347 . . . . 0.0 110.955 172.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.4 t -119.01 117.57 54.73 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 125.991 1.716 . . . . 0.0 107.856 174.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -102.09 65.74 0.99 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.213 1.005 . . . . 0.0 112.165 -169.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 2.7 m -79.32 3.91 16.77 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 114.258 1.207 . . . . 0.0 114.258 -173.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.95 -26.08 54.48 Favored Glycine 0 CA--C 1.542 1.727 0 CA-C-N 119.927 1.24 . . . . 0.0 114.316 171.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -91.68 7.34 79.68 Favored Glycine 0 CA--C 1.542 1.738 0 C-N-CA 125.437 1.494 . . . . 0.0 115.374 172.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -112.74 170.31 8.28 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.181 1.792 . . . . 0.0 112.537 -174.13 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.9 tt -46.53 -43.17 16.72 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.63 1.572 . . . . 0.0 111.089 169.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 96.3 mt -55.13 -43.23 73.93 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.248 1.019 . . . . 0.0 112.522 173.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -70.64 -39.1 67.61 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 124.984 1.278 . . . . 0.0 113.62 177.275 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -63.52 -42.61 98.46 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 120.363 2.082 . . . . 0.0 110.696 174.074 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 40.2 tp -62.7 -51.59 66.6 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.976 1.711 . . . . 0.0 112.52 -178.477 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -97.26 -8.48 29.73 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 -176.251 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 82.69 -24.68 4.94 Favored Glycine 0 CA--C 1.54 1.613 0 C-N-CA 125.492 1.52 . . . . 0.0 113.126 -169.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.18 137.21 10.39 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 127.049 2.14 . . . . 0.0 111.611 175.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -148.44 45.1 1.04 Allowed 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.153 0.981 . . . . 0.0 110.161 169.05 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 11.5 m -99.51 131.17 45.69 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 120.933 -1.104 . . . . 0.0 110.368 170.115 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 35.7 p90 -165.16 178.78 6.74 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.589 1.555 . . . . 0.0 111.98 -168.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 77.3 p -127.21 143.88 51.16 Favored 'General case' 0 N--CA 1.456 -0.162 0 N-CA-C 114.63 1.345 . . . . 0.0 114.63 174.157 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.3 m -72.1 -16.84 18.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 N-CA-C 114.042 1.127 . . . . 0.0 114.042 -173.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.5 pttt -74.43 -9.49 58.64 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.854 1.662 . . . . 0.0 114.108 172.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -121.09 79.84 34.59 Favored Pre-proline 0 CA--C 1.549 0.906 0 C-N-CA 126.091 1.757 . . . . 0.0 110.154 -179.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.14 -28.52 28.11 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 123.449 2.766 . . . . 0.0 114.712 -169.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 59.2 m -57.51 -54.14 58.17 Favored Pre-proline 0 N--CA 1.477 0.882 0 CA-C-N 120.147 1.339 . . . . 0.0 113.721 -177.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -66.16 -27.26 49.17 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 121.889 1.726 . . . . 0.0 112.854 174.323 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.21 -53.41 57.31 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.255 1.022 . . . . 0.0 110.568 175.295 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -63.77 -32.45 73.96 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.72 0.808 . . . . 0.0 112.52 173.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -62.47 -43.85 97.81 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 120.123 1.329 . . . . 0.0 112.844 175.116 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 23.5 mtm -63.5 -49.67 72.64 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.023 0.529 . . . . 0.0 111.729 171.475 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.8 mp -62.43 -36.78 83.46 Favored 'General case' 0 C--O 1.219 -0.547 0 CA-C-O 117.696 -1.145 . . . . 0.0 111.808 -177.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 -55.1 -24.49 25.9 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 121.336 1.88 . . . . 0.0 113.662 171.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -89.99 -15.08 32.65 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 125.367 1.467 . . . . 0.0 114.559 173.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -132.37 2.69 3.88 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 115.595 1.702 . . . . 0.0 115.595 -177.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 62.0 tp . . . . . 0 CA--C 1.54 0.577 0 C-N-CA 128.251 2.62 . . . . 0.0 108.573 -178.705 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.6 m . . . . . 0 N--CA 1.48 1.033 0 CA-C-O 121.173 0.511 . . . . 0.0 111.84 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -81.8 140.91 47.34 Favored Pre-proline 0 N--CA 1.481 1.121 0 C-N-CA 124.547 1.139 . . . . 0.0 112.941 -169.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -70.28 175.6 8.31 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 123.793 2.995 . . . . 0.0 113.791 175.003 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 17.3 ttmt -60.56 147.27 42.14 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.564 1.145 . . . . 0.0 109.617 172.253 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 73.6 mt -57.12 -47.05 99.73 Favored Pre-proline 0 N--CA 1.474 0.744 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 -167.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -66.82 -23.63 47.71 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 CA-C-N 121.8 1.679 . . . . 0.0 114.609 176.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.409 ' C ' HD23 ' A' ' 33' ' ' LEU . 5.6 tt -65.92 -44.11 86.12 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 120.057 1.299 . . . . 0.0 109.31 172.61 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 36.6 tp -62.13 -39.99 94.42 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 121.738 -0.601 . . . . 0.0 111.729 172.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.8 mmpt? -61.28 -39.81 91.81 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.339 0.655 . . . . 0.0 112.698 174.04 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 63.5 mt -64.33 -35.56 74.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 124.355 1.062 . . . . 0.0 112.224 174.402 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.1 mt -70.65 -34.87 72.51 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 119.666 1.121 . . . . 0.0 111.944 171.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 50.9 m170 -61.19 -42.32 98.36 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.053 0.842 . . . . 0.0 111.275 169.48 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.66 -24.86 67.72 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.512 1.125 . . . . 0.0 113.513 175.023 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.458 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -71.51 -7.02 44.91 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 124.155 0.982 . . . . 0.0 113.141 171.284 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 85.49 12.78 71.92 Favored Glycine 0 CA--C 1.537 1.421 0 C-N-CA 125.205 1.383 . . . . 0.0 114.146 -173.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -106.3 140.9 38.51 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.955 1.302 . . . . 0.0 112.637 -176.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -76.66 162.55 27.64 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 121.721 -0.612 . . . . 0.0 110.479 169.036 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -162.99 130.42 2.24 Favored Glycine 0 CA--C 1.526 0.747 0 O-C-N 121.432 -0.792 . . . . 0.0 114.982 -178.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -142.17 66.68 1.33 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 126.227 1.811 . . . . 0.0 109.162 173.276 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . 0.419 0.6 OUTLIER 63.38 145.86 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 129.537 3.135 . . . . 0.0 118.191 -175.013 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -162.72 169.55 19.81 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.089 1.756 . . . . 0.0 113.07 -168.745 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 41.8 p -79.96 171.37 15.19 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 125.244 1.418 . . . . 0.0 112.01 169.5 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -59.52 -39.19 78.68 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 O-C-N 120.549 -1.345 . . . . 0.0 111.676 173.736 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -62.18 -45.57 92.82 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.272 1.429 . . . . 0.0 112.724 176.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -68.76 -38.88 80.42 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.259 0.624 . . . . 0.0 112.176 176.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 8.5 t -58.37 -45.3 89.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 124.689 1.196 . . . . 0.0 111.126 170.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -69.3 -33.97 73.98 Favored 'General case' 0 CA--C 1.519 -0.242 0 C-N-CA 126.942 2.097 . . . . 0.0 114.512 -172.425 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -51.56 -49.29 62.32 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 120.699 0.285 . . . . 0.0 111.149 169.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -74.77 -32.26 62.01 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 172.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.91 -40.79 78.89 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 120.431 1.469 . . . . 0.0 112.43 178.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -60.18 -45.62 95.71 Favored Glycine 0 CA--C 1.529 0.919 0 N-CA-C 111.269 -0.732 . . . . 0.0 111.269 171.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 11.0 tp60 -58.32 -42.61 87.12 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.269 1.028 . . . . 0.0 112.582 173.294 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.458 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 56.3 t80 -61.13 -50.12 74.48 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.078 0.951 . . . . 0.0 110.544 174.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 72.4 mt -61.44 -37.13 77.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 123.781 0.833 . . . . 0.0 111.154 178.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 34.3 mmt -67.58 -42.97 81.65 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 119.502 1.046 . . . . 0.0 113.256 174.183 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.3 p -78.49 -27.42 14.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 CA-C-N 119.738 1.154 . . . . 0.0 113.267 -176.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 56.4 mmtt -93.24 -15.69 25.6 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.266 1.427 . . . . 0.0 113.566 174.134 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 14.8 mp0 54.36 61.29 3.09 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.68 1.992 . . . . 0.0 113.022 -175.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.2 tp -94.4 10.12 35.6 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.48 1.112 . . . . 0.0 112.873 -176.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 25.1 p90 -113.26 155.43 25.1 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 127.128 2.171 . . . . 0.0 111.49 -178.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -80.96 129.64 34.63 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 122.048 -0.408 . . . . 0.0 110.174 169.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 7.7 pm0 -59.02 -33.88 71.24 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -173.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -108.02 -27.88 9.88 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.498 1.119 . . . . 0.0 112.185 -171.406 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -109.14 56.5 0.62 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.763 2.025 . . . . 0.0 111.019 171.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -60.71 -18.63 55.43 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 124.494 1.118 . . . . 0.0 113.434 -175.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 29.6 p80 -63.26 -14.8 53.56 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.584 1.154 . . . . 0.0 114.013 171.367 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 13.8 ttm -111.64 141.72 44.87 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.007 1.323 . . . . 0.0 112.132 172.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.5 t -122.99 133.3 69.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 126.258 1.823 . . . . 0.0 108.821 175.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 6.6 t80 -113.32 52.07 0.81 Allowed 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.77 0.795 . . . . 0.0 112.968 -169.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 4.9 m -71.52 -6.37 40.12 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 -175.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -55.54 -25.54 42.69 Favored Glycine 0 CA--C 1.541 1.657 0 C-N-CA 125.439 1.495 . . . . 0.0 115.148 177.165 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -88.47 0.24 82.95 Favored Glycine 0 CA--C 1.541 1.658 0 C-N-CA 125.051 1.31 . . . . 0.0 115.601 175.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -131.92 -176.07 3.93 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 126.067 1.747 . . . . 0.0 112.072 -171.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -46.71 -47.05 20.55 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.833 2.053 . . . . 0.0 113.871 -170.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 94.0 mt -60.08 -37.81 81.03 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.81 1.244 . . . . 0.0 112.564 175.162 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -73.16 -34.24 58.42 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 125.697 1.617 . . . . 0.0 114.311 175.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -66.51 -42.39 87.42 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 119.68 1.74 . . . . 0.0 110.444 171.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 32.9 tp -61.53 -50.77 71.33 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.401 1.48 . . . . 0.0 112.524 179.049 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -99.02 -14.27 19.53 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 115.154 1.538 . . . . 0.0 115.154 -175.442 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 82.35 -19.1 11.37 Favored Glycine 0 CA--C 1.541 1.665 0 C-N-CA 125.729 1.633 . . . . 0.0 116.114 179.448 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.0 24.12 1.18 Allowed 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 -176.794 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -71.26 52.65 0.18 Allowed 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 117.533 2.42 . . . . 0.0 117.533 -167.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 36.0 m -117.79 139.06 51.6 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.235 1.014 . . . . 0.0 108.53 168.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 45.8 p90 -159.34 167.12 29.66 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -167.245 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 2.1 m -99.91 136.29 40.05 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.608 1.563 . . . . 0.0 110.328 169.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 6.9 m -77.6 -19.87 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 124.399 1.079 . . . . 0.0 112.803 175.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 61.3 pttt -80.56 -2.94 48.38 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 127.592 2.357 . . . . 0.0 115.114 -179.256 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . 0.401 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 48.9 t0 -125.94 94.26 42.17 Favored Pre-proline 0 CA--C 1.549 0.92 0 C-N-CA 126.592 1.957 . . . . 0.0 110.267 -171.36 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 94' ' ' ASP . 20.3 Cg_endo -61.5 -31.39 87.66 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 123.936 3.091 . . . . 0.0 115.529 -174.799 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 66.8 m -58.53 -53.1 69.65 Favored Pre-proline 0 N--CA 1.477 0.882 0 CA-C-N 119.92 1.236 . . . . 0.0 114.057 -178.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -68.39 -24.33 36.99 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 122.034 1.823 . . . . 0.0 113.49 174.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 61.5 mt -65.9 -47.08 75.99 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 119.522 1.055 . . . . 0.0 111.058 174.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -58.13 -41.3 83.36 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 178.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -58.74 -51.72 68.77 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 118.963 0.801 . . . . 0.0 112.487 176.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 34.0 mtm -64.16 -49.69 71.09 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.266 0.626 . . . . 0.0 112.287 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.4 mp -63.61 -49.38 73.54 Favored 'General case' 0 C--O 1.224 -0.263 0 C-N-CA 124.568 1.147 . . . . 0.0 110.756 -176.682 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -60.32 -19.21 54.39 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 120.238 1.381 . . . . 0.0 113.647 178.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -96.74 -14.14 22.21 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.948 1.699 . . . . 0.0 114.435 175.126 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -118.23 -21.39 8.19 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-N 120.047 1.294 . . . . 0.0 113.742 -178.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 43.8 tp . . . . . 0 CA--C 1.536 0.439 0 C-N-CA 127.225 2.21 . . . . 0.0 107.787 169.26 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 35.0 m . . . . . 0 N--CA 1.477 0.914 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 37.6 mtm180 -91.39 145.25 31.04 Favored Pre-proline 0 N--CA 1.479 1.01 0 C-N-CA 124.405 1.082 . . . . 0.0 112.482 -175.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -75.78 177.92 8.09 Favored 'Trans proline' 0 CA--C 1.54 0.807 0 C-N-CA 124.152 3.235 . . . . 0.0 111.499 169.324 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.7 ttmt -69.24 148.53 49.68 Favored 'General case' 0 CA--C 1.536 0.442 0 O-C-N 121.638 -0.664 . . . . 0.0 111.237 178.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 10.0 mp -53.67 -55.17 38.17 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 125.133 1.373 . . . . 0.0 114.548 -169.236 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -65.46 -22.0 59.7 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 122.297 1.998 . . . . 0.0 113.845 175.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.0 tt -75.21 -32.41 61.18 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 119.88 1.218 . . . . 0.0 110.988 172.573 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.3 tp -63.69 -37.31 86.88 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.308 -0.87 . . . . 0.0 111.017 169.189 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.42 ' HA ' ' HE2' ' A' ' 35' ' ' LYS . 8.9 mmpt? -62.61 -37.62 86.96 Favored 'General case' 0 N--CA 1.479 0.998 0 O-C-N 121.674 -0.641 . . . . 0.0 112.34 173.241 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 90.4 mt -62.94 -39.0 83.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 124.067 0.947 . . . . 0.0 111.467 172.507 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.3 mp -70.35 -33.06 71.01 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 120.715 -1.241 . . . . 0.0 113.332 172.175 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 63.5 m170 -64.46 -41.36 96.56 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 120.957 -1.09 . . . . 0.0 111.401 170.388 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.28 -24.12 67.72 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.013 0.925 . . . . 0.0 113.323 172.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.488 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -72.09 -9.12 57.97 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 123.955 0.902 . . . . 0.0 113.425 172.158 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.51 7.75 64.75 Favored Glycine 0 CA--C 1.538 1.491 0 C-N-CA 125.4 1.476 . . . . 0.0 114.572 -175.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -94.08 166.54 12.08 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.67 1.188 . . . . 0.0 113.08 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.1 tm0? -126.53 144.53 50.84 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.839 1.656 . . . . 0.0 108.973 169.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -174.71 165.48 36.79 Favored Glycine 0 C--N 1.339 0.711 0 N-CA-C 116.496 1.358 . . . . 0.0 116.496 -170.416 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -141.26 -65.38 0.43 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.408 1.883 . . . . 0.0 109.18 169.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 25.9 mtm -106.29 142.76 35.43 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 127.811 2.445 . . . . 0.0 112.169 -178.069 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -157.4 162.95 39.03 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.062 0.945 . . . . 0.0 113.419 -173.714 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 81.2 p -94.97 172.85 7.9 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.613 1.165 . . . . 0.0 108.366 166.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -57.4 -46.88 85.62 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.426 0 O-C-N 120.082 -1.636 . . . . 0.0 109.817 169.45 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -55.97 -39.89 72.45 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.786 1.234 . . . . 0.0 112.649 -179.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -74.2 -37.29 63.93 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 175.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 97.0 t -68.71 -49.66 62.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 CA-C-N 119.946 1.248 . . . . 0.0 111.978 175.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 11.5 mmm -67.63 -28.05 67.4 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 119.229 0.922 . . . . 0.0 112.99 -170.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -53.44 -54.03 42.77 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 114.84 -1.073 . . . . 0.0 111.355 169.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -74.35 -35.22 63.57 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 176.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.32 -37.56 77.79 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 121.131 -0.98 . . . . 0.0 112.107 178.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -64.99 -42.82 96.6 Favored Glycine 0 CA--C 1.529 0.929 0 C-N-CA 124.588 1.09 . . . . 0.0 112.054 172.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 30.4 tp60 -57.94 -44.54 87.01 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.046 0.938 . . . . 0.0 111.641 169.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.488 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 70.9 t80 -60.86 -52.18 66.13 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.505 0.722 . . . . 0.0 111.304 176.257 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 25.8 mt -58.79 -36.83 62.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 124.376 1.07 . . . . 0.0 111.371 177.324 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.6 tpt -66.39 -45.04 81.38 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 125.206 1.402 . . . . 0.0 112.684 175.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.7 p -78.51 -27.28 14.14 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 CA-C-N 119.709 1.14 . . . . 0.0 113.488 -177.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 53.7 mmtt -90.97 -15.74 29.18 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 125.287 1.435 . . . . 0.0 113.494 173.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 16.0 mp0 54.69 63.94 1.98 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 127.412 2.285 . . . . 0.0 113.417 -175.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.7 mt -91.86 -8.13 47.38 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.59 0.756 . . . . 0.0 113.007 176.133 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 54.2 p90 -76.61 153.39 35.32 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.845 0.858 . . . . 0.0 111.072 170.028 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -82.82 130.81 35.18 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 121.719 -0.613 . . . . 0.0 110.828 171.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -64.11 -25.36 68.06 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 120.969 -1.082 . . . . 0.0 113.353 -177.73 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -91.69 -22.72 20.09 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 123.923 0.889 . . . . 0.0 111.671 -172.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -149.84 75.42 1.25 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 129.327 3.051 . . . . 0.0 109.662 -174.067 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 29.9 mp0 -60.7 -18.64 55.42 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -173.405 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 1.6 p-80 -63.7 -29.74 70.93 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 113.469 0.915 . . . . 0.0 113.469 169.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 16.9 tpp -81.35 130.01 34.86 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.515 1.126 . . . . 0.0 110.532 171.584 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.5 t -124.81 117.38 50.1 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 C-N-CA 126.099 1.76 . . . . 0.0 108.664 177.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -96.77 73.53 2.65 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.165 1.386 . . . . 0.0 110.713 -177.163 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 72.5 m -76.76 -0.81 25.16 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 121.208 -0.932 . . . . 0.0 112.944 171.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.58 -25.63 58.62 Favored Glycine 0 CA--C 1.541 1.685 0 O-C-N 120.557 -1.34 . . . . 0.0 113.879 169.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -87.56 3.77 86.19 Favored Glycine 0 CA--C 1.542 1.731 0 C-N-CA 125.32 1.438 . . . . 0.0 115.224 171.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -107.57 167.51 9.9 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 126.231 1.812 . . . . 0.0 112.438 -176.372 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.9 tp -46.61 -43.0 17.0 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.184 1.794 . . . . 0.0 111.917 169.152 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 13.9 tp -59.38 -41.35 89.15 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.412 1.485 . . . . 0.0 111.74 175.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -65.16 -42.35 96.49 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 124.935 1.255 . . . . 0.0 113.834 171.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -63.33 -47.31 82.74 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 120.211 2.006 . . . . 0.0 110.679 177.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.4 pp -70.36 -32.49 70.2 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -176.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.15 -9.04 31.58 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 119.783 1.174 . . . . 0.0 112.854 175.228 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 80.43 -26.5 3.03 Favored Glycine 0 CA--C 1.541 1.659 0 C-N-CA 125.909 1.718 . . . . 0.0 113.437 -171.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -161.27 134.84 6.61 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 128.741 2.817 . . . . 0.0 109.425 176.25 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -142.6 28.56 1.61 Allowed 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 119.132 0.878 . . . . 0.0 111.32 174.01 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.2 m -91.78 142.69 27.31 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 121.591 -0.693 . . . . 0.0 111.95 -178.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 50.0 p90 -160.97 169.44 22.56 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.315 1.046 . . . . 0.0 112.41 -169.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 5.3 t -125.01 136.49 53.76 Favored 'General case' 0 N--CA 1.462 0.148 0 C-N-CA 123.584 0.754 . . . . 0.0 110.755 169.305 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 33.9 m -71.35 -11.69 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 N-CA-C 114.325 1.231 . . . . 0.0 114.325 -174.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -73.88 -11.21 60.29 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.338 1.055 . . . . 0.0 113.549 169.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 47.0 t0 -121.39 77.71 35.36 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 126.9 2.08 . . . . 0.0 109.303 179.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -71.39 -28.26 18.29 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 123.478 2.786 . . . . 0.0 115.017 -169.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 49.8 m -57.35 -52.26 75.56 Favored Pre-proline 0 N--CA 1.477 0.898 0 CA-C-N 119.987 1.267 . . . . 0.0 114.25 -177.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -66.47 -30.63 43.54 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 122.193 1.929 . . . . 0.0 113.239 176.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 40.8 tp -65.55 -48.29 72.93 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.281 1.032 . . . . 0.0 110.312 175.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -60.45 -41.48 94.17 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 118.484 -0.769 . . . . 0.0 112.405 172.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -58.28 -47.53 83.34 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 120.128 1.331 . . . . 0.0 112.645 -179.717 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 46.0 mtm -66.32 -49.6 66.46 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.461 0.705 . . . . 0.0 112.314 175.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.7 mp -65.58 -37.16 85.87 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-O 117.957 -1.021 . . . . 0.0 111.571 -177.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 91.4 mtt180 -55.43 -22.7 21.45 Favored 'General case' 0 N--CA 1.484 1.226 0 CA-C-N 120.732 1.606 . . . . 0.0 113.828 169.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -92.16 -16.24 26.54 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.792 1.637 . . . . 0.0 113.709 175.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -128.72 -10.83 4.96 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 116.185 1.921 . . . . 0.0 116.185 -176.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.1 tt . . . . . 0 CA--C 1.542 0.666 0 C-N-CA 126.84 2.056 . . . . 0.0 111.315 -167.508 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 22.2 m . . . . . 0 N--CA 1.477 0.914 0 CA-C-O 120.725 0.298 . . . . 0.0 110.907 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 43.8 mtt180 -92.24 140.7 24.46 Favored Pre-proline 0 N--CA 1.48 1.027 0 C-N-CA 124.098 0.959 . . . . 0.0 111.502 -176.628 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -76.34 176.72 9.7 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 123.667 2.912 . . . . 0.0 111.327 169.578 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt -68.19 153.39 43.84 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.547 0.739 . . . . 0.0 110.58 179.44 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 93.5 mt -60.65 -43.9 93.68 Favored Pre-proline 0 N--CA 1.478 0.946 0 N-CA-C 114.543 1.312 . . . . 0.0 114.543 -169.376 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -65.85 -26.2 52.3 Favored 'Trans proline' 0 C--N 1.353 0.794 0 CA-C-N 121.616 1.613 . . . . 0.0 113.287 172.184 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.39 -42.33 75.27 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.437 1.095 . . . . 0.0 110.948 174.776 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.7 tt -61.12 -36.7 80.45 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 120.969 -1.082 . . . . 0.0 111.292 170.042 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -63.77 -37.95 89.27 Favored 'General case' 0 N--CA 1.482 1.154 0 O-C-N 121.082 -1.011 . . . . 0.0 113.394 169.839 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.8 mt -60.26 -41.63 87.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 CA-C-N 120.238 1.381 . . . . 0.0 111.434 171.05 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.8 mp -66.61 -36.71 83.26 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 119.428 1.013 . . . . 0.0 112.133 174.175 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 28.5 m170 -63.36 -43.17 98.43 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 121.046 -1.034 . . . . 0.0 111.674 172.007 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.66 -28.31 69.83 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.266 1.027 . . . . 0.0 113.042 173.539 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.492 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -69.44 -15.07 63.21 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 124.155 0.982 . . . . 0.0 113.302 172.471 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 102.23 8.17 44.82 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 125.997 1.76 . . . . 0.0 114.884 -176.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -95.95 173.38 7.46 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 118.803 1.301 . . . . 0.0 113.901 -176.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.5 tm0? -136.77 143.28 43.15 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.921 1.688 . . . . 0.0 109.248 169.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 169.68 -179.73 41.94 Favored Glycine 0 N--CA 1.467 0.706 0 N-CA-C 115.241 0.856 . . . . 0.0 115.241 179.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -139.47 -57.23 0.58 Allowed 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.129 1.772 . . . . 0.0 110.824 -178.068 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 16.0 mtm -103.73 142.01 35.1 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 127.988 2.515 . . . . 0.0 111.257 173.165 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -154.79 144.99 21.9 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.292 1.037 . . . . 0.0 112.662 -176.138 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 43.7 p -76.12 172.04 13.48 Favored 'General case' 0 N--CA 1.484 1.263 0 O-C-N 121.121 -0.987 . . . . 0.0 111.094 168.334 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -56.76 -40.95 73.81 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.258 0 O-C-N 120.718 -1.239 . . . . 0.0 110.683 168.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -68.24 -40.76 81.91 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.429 1.092 . . . . 0.0 112.61 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 59.7 mt-10 -66.65 -40.99 88.93 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.591 0.756 . . . . 0.0 111.551 175.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 52.9 t -61.37 -48.58 88.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 O-C-N 121.785 -0.572 . . . . 0.0 110.841 171.525 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.43 -38.12 89.93 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 125.91 1.684 . . . . 0.0 113.955 -176.402 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 85.3 t60 -53.24 -51.6 61.65 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.297 0.639 . . . . 0.0 111.623 171.077 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -74.56 -32.48 62.43 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 176.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -71.85 -39.25 69.84 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.674 1.124 . . . . 0.0 112.564 178.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -60.4 -41.11 98.4 Favored Glycine 0 CA--C 1.536 1.393 0 CA-C-N 119.358 0.981 . . . . 0.0 111.732 171.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.6 tp60 -60.24 -51.37 69.86 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.479 1.512 . . . . 0.0 111.913 170.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.492 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 55.6 t80 -58.93 -49.99 75.73 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.0 -1.062 . . . . 0.0 110.397 179.766 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 56.7 mt -62.29 -36.51 74.94 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 124.896 1.278 . . . . 0.0 111.373 179.298 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 5.8 tpt -64.58 -40.08 94.89 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 119.6 1.091 . . . . 0.0 112.26 172.646 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 96.6 t -78.31 -34.08 18.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 124.293 1.037 . . . . 0.0 112.971 -179.052 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 47.4 mmtt -89.11 -15.68 33.31 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.89 1.276 . . . . 0.0 113.06 178.439 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 14.8 mp0 49.06 69.11 0.61 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.409 2.284 . . . . 0.0 112.601 -171.204 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 9.8 tp -90.74 -1.49 57.85 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.119 0.968 . . . . 0.0 112.776 -176.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -102.09 158.64 16.02 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.861 2.064 . . . . 0.0 111.184 175.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -88.47 127.69 35.52 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 169.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.26 -33.21 52.14 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.882 1.068 . . . . 0.0 113.882 179.553 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -90.38 -16.28 29.42 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.577 1.151 . . . . 0.0 112.466 -173.388 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -143.1 64.56 1.35 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 128.059 2.544 . . . . 0.0 109.432 -177.071 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -60.06 -21.82 61.92 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 121.241 -0.912 . . . . 0.0 113.053 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 5.6 p-80 -65.87 -6.55 12.55 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.31 1.444 . . . . 0.0 114.18 169.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 7.2 tpp -117.55 132.12 56.58 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 127.376 2.27 . . . . 0.0 110.379 174.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 11.7 t -115.4 123.28 70.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 126.017 1.727 . . . . 0.0 108.298 175.28 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 81.0 t80 -109.14 103.68 12.72 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.21 1.004 . . . . 0.0 109.913 -178.068 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 73.0 m -95.67 15.11 20.89 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -175.047 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.54 118.8 14.8 Favored Glycine 0 CA--C 1.535 1.334 0 O-C-N 121.468 -0.77 . . . . 0.0 112.093 179.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 76.96 5.62 84.86 Favored Glycine 0 CA--C 1.541 1.717 0 C-N-CA 124.485 1.04 . . . . 0.0 115.512 -175.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -93.79 158.66 15.55 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.189 1.494 . . . . 0.0 112.044 174.51 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 64.6 mt -48.96 -35.38 15.01 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.811 1.244 . . . . 0.0 113.286 177.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -58.88 -45.37 90.38 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.595 0.758 . . . . 0.0 111.743 175.037 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -74.7 -33.93 54.59 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 125.407 1.48 . . . . 0.0 113.902 176.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -59.32 -46.55 88.3 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-N 120.748 2.274 . . . . 0.0 110.096 171.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 32.0 tp -68.88 -51.63 38.16 Favored 'General case' 0 CA--C 1.552 1.054 0 CA-C-N 114.303 -1.317 . . . . 0.0 113.178 -176.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -89.55 -8.34 52.95 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 124.312 1.045 . . . . 0.0 112.608 -177.224 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 83.98 -27.04 4.56 Favored Glycine 0 CA--C 1.541 1.657 0 O-C-N 119.866 -1.771 . . . . 0.0 112.714 -169.566 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.12 140.31 4.39 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 128.55 2.74 . . . . 0.0 110.655 178.288 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -142.76 35.98 1.43 Allowed 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.795 0.838 . . . . 0.0 110.931 169.411 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 5.1 m -86.86 125.01 33.7 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 120.712 -1.242 . . . . 0.0 109.663 169.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -163.6 169.18 18.99 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.176 1.391 . . . . 0.0 111.859 -169.32 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 13.0 m -115.65 136.14 53.36 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.045 -0.98 . . . . 0.0 111.536 176.173 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -77.76 -14.35 14.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 124.483 1.113 . . . . 0.0 113.519 -169.205 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.2 pttt -75.26 -8.36 56.41 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.478 1.511 . . . . 0.0 114.651 169.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -117.99 83.88 20.05 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 126.394 1.878 . . . . 0.0 110.522 -175.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -67.08 -31.44 36.75 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 123.725 2.95 . . . . 0.0 114.855 -171.677 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 54.5 m -58.32 -51.97 77.96 Favored Pre-proline 0 N--CA 1.476 0.85 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -176.066 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -67.28 -33.98 28.82 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 121.88 1.72 . . . . 0.0 112.58 174.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 8.2 tp -60.38 -46.48 89.82 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.867 1.267 . . . . 0.0 110.878 176.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -56.97 -38.27 72.75 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.294 0.952 . . . . 0.0 112.52 177.257 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -64.76 -51.46 62.17 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.584 1.084 . . . . 0.0 112.379 177.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -68.52 -29.52 68.13 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 114.06 1.133 . . . . 0.0 114.06 177.538 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 39.7 tp -75.58 -53.54 8.45 Favored 'General case' 0 C--O 1.224 -0.255 0 C-N-CA 126.506 1.922 . . . . 0.0 110.972 178.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 49.9 mtp180 -59.48 -27.39 66.08 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-N 119.42 1.009 . . . . 0.0 113.474 -176.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -75.97 -26.4 56.76 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.297 1.439 . . . . 0.0 113.691 173.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 34.5 m-20 -104.75 -21.54 13.35 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 179.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 21.0 tp . . . . . 0 CA--C 1.535 0.373 0 C-N-CA 127.916 2.487 . . . . 0.0 107.337 171.428 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.1 m . . . . . 0 N--CA 1.485 1.288 0 N-CA-C 113.332 0.864 . . . . 0.0 113.332 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.403 ' HG2' ' HB3' ' A' ' 46' ' ' MET . 43.4 mtm180 -69.54 146.89 96.5 Favored Pre-proline 0 N--CA 1.486 1.371 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -169.567 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo -88.9 -177.14 1.56 Allowed 'Trans proline' 0 C--N 1.354 0.823 1 C-N-CA 125.392 4.061 . . . . 0.0 113.447 -176.304 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.0 ttmt -68.03 147.85 51.81 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.745 0.818 . . . . 0.0 109.128 169.182 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 92.4 mt -60.2 -42.07 87.67 Favored Pre-proline 0 N--CA 1.478 0.929 0 N-CA-C 115.354 1.612 . . . . 0.0 115.354 -168.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -59.58 -31.4 94.41 Favored 'Trans proline' 0 CA--C 1.537 0.631 0 CA-C-N 121.76 1.664 . . . . 0.0 114.032 176.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.1 tt -64.4 -44.77 90.22 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.071 0.851 . . . . 0.0 110.536 175.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 49.7 tp -61.11 -39.04 88.5 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.229 0.612 . . . . 0.0 111.797 175.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -67.21 -36.62 82.1 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 175.256 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 87.5 mt -63.89 -42.55 96.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 123.828 0.851 . . . . 0.0 111.346 171.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 97.7 mt -63.65 -37.2 86.45 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.154 -0.966 . . . . 0.0 112.661 173.143 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 65.2 m170 -61.76 -44.66 96.46 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 118.813 0.733 . . . . 0.0 111.581 169.804 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.76 -28.72 69.77 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.184 0.994 . . . . 0.0 112.976 177.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.438 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -73.99 -3.81 31.49 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.456 1.102 . . . . 0.0 113.552 172.445 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.81 12.32 60.74 Favored Glycine 0 CA--C 1.536 1.375 0 C-N-CA 125.177 1.37 . . . . 0.0 115.355 177.17 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -106.93 156.39 18.76 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.011 1.325 . . . . 0.0 112.736 -179.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -80.62 -178.48 6.76 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.684 -0.635 . . . . 0.0 111.07 169.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 176.79 155.01 12.56 Favored Glycine 0 C--N 1.34 0.781 0 N-CA-C 118.497 2.159 . . . . 0.0 118.497 176.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -147.01 -67.71 0.26 Allowed 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 127.227 2.211 . . . . 0.0 108.078 169.18 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.403 ' HB3' ' HG2' ' A' ' 28' ' ' ARG . 1.5 pmm? -130.09 154.63 47.27 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 126.214 1.806 . . . . 0.0 115.548 176.388 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -154.57 160.81 41.72 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 115.183 1.549 . . . . 0.0 115.183 -168.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 44.6 p -96.42 173.26 7.46 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 127.028 2.131 . . . . 0.0 109.893 167.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.2 t -56.54 -41.94 74.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 CA-C-N 120.785 1.629 . . . . 0.0 110.001 169.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 56.8 tptt -60.27 -43.17 96.43 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.729 1.15 . . . . 0.0 112.386 -179.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -74.12 -36.89 64.23 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 83.3 t -67.85 -50.57 58.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 CA-C-N 118.959 0.799 . . . . 0.0 111.013 172.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.6 ppp? -69.54 -26.52 64.54 Favored 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 114.55 1.315 . . . . 0.0 114.55 -168.572 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -57.77 -54.24 49.08 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.289 0.636 . . . . 0.0 110.826 171.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -74.54 -31.08 62.01 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 176.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -69.43 -39.1 78.06 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 120.61 1.55 . . . . 0.0 112.627 175.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.6 -47.36 89.81 Favored Glycine 0 CA--C 1.53 1.011 0 CA-C-N 118.986 0.812 . . . . 0.0 111.466 172.051 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.0 tp60 -57.62 -43.22 84.61 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.313 1.045 . . . . 0.0 112.356 172.503 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.438 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 59.4 t80 -62.79 -53.8 48.8 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.28 1.432 . . . . 0.0 110.621 177.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 34.7 mt -57.04 -37.36 54.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 124.288 1.035 . . . . 0.0 110.751 177.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 40.3 mmm -70.23 -41.47 73.55 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 114.141 1.163 . . . . 0.0 114.141 176.191 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.8 p -78.48 -26.31 13.92 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 CA-C-N 119.974 1.261 . . . . 0.0 112.99 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 55.5 mmtt -91.77 -14.44 29.87 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.817 1.647 . . . . 0.0 113.253 173.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.8 mp0 52.19 62.3 2.77 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 126.766 2.026 . . . . 0.0 113.673 -176.182 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 45.8 mt -88.37 -5.24 58.42 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 121.576 -0.703 . . . . 0.0 112.749 174.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 46.3 p90 -84.62 157.19 21.25 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.986 1.314 . . . . 0.0 111.703 172.573 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -87.41 126.83 35.11 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 169.454 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.46 -30.74 61.11 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 179.084 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -94.73 -21.08 18.98 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.712 1.205 . . . . 0.0 112.809 -170.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -140.07 68.44 1.36 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 127.765 2.426 . . . . 0.0 109.056 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -63.35 -16.96 61.99 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 114.05 1.13 . . . . 0.0 114.05 -169.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 32.8 p80 -61.53 -29.89 70.29 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 118.706 -0.664 . . . . 0.0 112.689 169.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 17.9 mtp -87.99 145.5 25.97 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 113.62 0.971 . . . . 0.0 113.62 176.186 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 t -131.0 131.21 64.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 C-N-CA 126.073 1.749 . . . . 0.0 108.743 173.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -112.66 103.57 11.61 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.553 1.541 . . . . 0.0 108.758 174.571 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 15.0 m -103.05 9.69 38.42 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.73 0.812 . . . . 0.0 112.402 176.008 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.75 -27.32 66.35 Favored Glycine 0 CA--C 1.537 1.444 0 C-N-CA 124.999 1.285 . . . . 0.0 114.795 -174.336 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -88.24 2.09 84.94 Favored Glycine 0 CA--C 1.54 1.631 0 C-N-CA 124.988 1.28 . . . . 0.0 115.202 173.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -110.67 177.78 4.57 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.471 1.508 . . . . 0.0 112.727 -175.061 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 80.4 mt -51.73 -35.84 44.79 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.205 1.402 . . . . 0.0 113.201 171.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 94.5 mt -61.2 -47.91 83.97 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 121.624 -0.673 . . . . 0.0 110.933 174.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -67.8 -34.79 83.76 Favored Glycine 0 CA--C 1.532 1.142 0 CA-C-O 119.032 -0.871 . . . . 0.0 113.464 176.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.42 -28.77 63.18 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 119.43 1.615 . . . . 0.0 112.449 176.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 40.8 tp -74.42 -53.61 9.23 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.875 1.27 . . . . 0.0 112.416 173.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -96.82 -17.24 20.34 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.787 1.403 . . . . 0.0 114.787 -169.442 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 80.85 -17.96 10.21 Favored Glycine 0 CA--C 1.539 1.584 0 C-N-CA 125.66 1.6 . . . . 0.0 116.061 -177.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.04 31.13 0.62 Allowed 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 116.362 1.986 . . . . 0.0 116.362 -174.23 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 8.0 mm-40 -69.35 73.17 0.33 Allowed 'General case' 0 N--CA 1.477 0.886 0 O-C-N 121.336 -0.852 . . . . 0.0 112.853 -179.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 12.1 m -134.38 136.43 43.36 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.083 1.353 . . . . 0.0 109.178 169.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 54.5 p90 -160.08 174.06 14.88 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -168.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.8 t -124.59 141.42 52.11 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 124.852 1.261 . . . . 0.0 110.548 169.019 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 25.9 m -72.0 -12.28 15.73 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 175.21 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 41.4 pttt -77.35 -10.71 59.61 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 113.683 0.994 . . . . 0.0 113.683 172.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -123.48 77.42 54.54 Favored Pre-proline 0 CA--C 1.548 0.866 0 C-N-CA 126.285 1.834 . . . . 0.0 109.642 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -68.83 -28.05 30.44 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 123.389 2.726 . . . . 0.0 114.873 -169.355 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 62.5 m -59.4 -55.14 49.05 Favored Pre-proline 0 N--CA 1.476 0.863 0 CA-C-N 120.172 1.351 . . . . 0.0 114.436 -177.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -65.88 -29.74 49.65 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 122.11 1.873 . . . . 0.0 112.93 176.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 26.5 tp -66.37 -46.48 76.55 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.89 0.876 . . . . 0.0 110.746 174.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -61.83 -39.25 91.14 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 118.557 -0.735 . . . . 0.0 112.638 172.253 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -59.36 -48.9 79.88 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 119.778 1.172 . . . . 0.0 112.599 177.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 41.3 mtm -62.31 -47.91 82.2 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.653 0.781 . . . . 0.0 112.634 173.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 61.7 mt -56.65 -45.26 81.73 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 124.312 1.045 . . . . 0.0 110.978 177.373 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 24.0 ttt180 -60.42 -21.64 62.47 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 120.052 1.296 . . . . 0.0 114.234 175.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -86.85 -17.5 33.21 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.5 1.52 . . . . 0.0 113.208 172.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 53.9 t30 -104.92 -25.19 12.69 Favored 'General case' 0 CA--C 1.555 1.138 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 176.547 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 55.1 tp . . . . . 0 CA--C 1.535 0.373 0 C-N-CA 128.739 2.816 . . . . 0.0 108.548 179.863 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 23.4 m . . . . . 0 N--CA 1.478 0.943 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.7 ttp-105 -101.39 129.85 26.04 Favored Pre-proline 0 N--CA 1.481 1.099 0 O-C-N 120.876 -1.14 . . . . 0.0 111.408 178.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -75.24 -177.03 3.22 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.736 2.958 . . . . 0.0 112.121 173.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.5 ttmt -64.06 148.09 50.6 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 121.394 -0.816 . . . . 0.0 110.668 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.9 mt -55.84 -45.85 99.83 Favored Pre-proline 0 N--CA 1.476 0.836 0 N-CA-C 115.225 1.565 . . . . 0.0 115.225 -168.361 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -64.8 -24.17 61.8 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 CA-C-N 122.219 1.828 . . . . 0.0 113.773 175.096 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 tp -66.68 -40.26 88.49 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.774 1.17 . . . . 0.0 110.919 172.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.9 tt -63.37 -37.91 89.09 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.824 0.85 . . . . 0.0 111.41 171.3 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.433 ' HA ' ' HE2' ' A' ' 35' ' ' LYS . 11.1 mmpt? -60.99 -43.21 99.2 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 121.516 -0.74 . . . . 0.0 112.565 171.242 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 83.3 mt -62.75 -42.38 96.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.994 0.918 . . . . 0.0 111.5 174.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 55.8 mt -63.57 -38.61 91.79 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.473 -0.767 . . . . 0.0 111.671 176.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 17.6 m170 -67.67 -41.05 84.32 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.584 -0.697 . . . . 0.0 111.789 172.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.37 -26.83 68.93 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.182 0.993 . . . . 0.0 113.292 174.043 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.435 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -71.25 -6.78 42.31 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.154 0.982 . . . . 0.0 113.462 171.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 94.75 7.19 60.24 Favored Glycine 0 CA--C 1.536 1.397 0 C-N-CA 125.638 1.59 . . . . 0.0 115.063 -178.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -89.09 170.64 10.46 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 118.931 1.365 . . . . 0.0 112.874 178.189 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 34.4 tp60 -128.14 139.03 52.72 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.607 1.563 . . . . 0.0 109.013 169.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 175.94 150.8 8.28 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 115.275 0.87 . . . . 0.0 115.275 -179.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -125.06 13.39 8.4 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 127.023 2.129 . . . . 0.0 111.641 172.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.2 mtm -174.9 134.44 0.35 Allowed 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 128.916 2.886 . . . . 0.0 109.343 -172.146 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -154.08 143.88 21.78 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.192 0.997 . . . . 0.0 113.145 -174.588 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 51.4 p -85.75 170.06 12.82 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 121.058 -1.026 . . . . 0.0 111.203 168.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 2.7 t -55.81 -43.92 75.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 O-C-N 120.337 -1.477 . . . . 0.0 110.391 169.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -57.29 -34.69 68.94 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 120.813 -1.179 . . . . 0.0 113.002 177.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -80.43 -45.79 17.04 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 113.183 0.808 . . . . 0.0 113.183 173.618 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 79.5 t -61.61 -49.1 85.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 123.482 0.713 . . . . 0.0 110.895 -177.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.71 -38.58 83.81 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 123.375 0.67 . . . . 0.0 111.944 -172.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -56.46 -52.45 64.65 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.423 176.558 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 45.9 m-85 -74.41 -29.93 61.71 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 176.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.4 mp -68.28 -37.91 81.18 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 120.793 1.633 . . . . 0.0 112.215 171.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -61.95 -43.41 99.22 Favored Glycine 0 CA--C 1.531 1.069 0 CA-C-N 119.13 0.877 . . . . 0.0 111.828 171.549 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.2 tp60 -60.89 -43.09 98.96 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.394 1.077 . . . . 0.0 112.446 171.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.435 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 49.4 t80 -61.35 -51.78 67.37 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.205 1.002 . . . . 0.0 110.58 175.44 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 69.1 mt -59.8 -38.56 76.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 124.54 1.136 . . . . 0.0 110.825 179.095 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.2 tpt -63.63 -47.63 80.56 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.985 1.314 . . . . 0.0 112.509 174.127 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.2 p -78.63 -28.46 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 -175.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 57.5 mmtt -91.97 -15.78 27.48 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.459 1.503 . . . . 0.0 113.522 174.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.4 mp0 55.06 63.6 2.07 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.947 2.099 . . . . 0.0 112.992 -174.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 11.2 tp -88.29 -9.37 53.06 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.003 0.921 . . . . 0.0 112.3 176.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 26.4 p90 -88.58 162.08 16.57 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.134 1.774 . . . . 0.0 110.874 169.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -99.9 129.67 46.01 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 122.029 -0.42 . . . . 0.0 110.72 169.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.2 -20.57 59.29 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 113.934 1.087 . . . . 0.0 113.934 173.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -82.94 -31.44 27.7 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.639 1.176 . . . . 0.0 111.347 -178.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -152.33 69.99 0.9 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.262 1.825 . . . . 0.0 111.957 -169.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 27.9 mp0 -56.36 -20.8 20.91 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.233 1.413 . . . . 0.0 113.795 -178.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 30.5 p80 -65.32 -12.82 55.67 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 174.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 22.5 tpp -111.61 135.97 51.46 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 126.621 1.968 . . . . 0.0 111.105 172.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 18.9 t -119.7 107.89 22.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 125.713 1.605 . . . . 0.0 108.309 171.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -92.15 110.98 22.37 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.223 0.609 . . . . 0.0 110.672 -177.143 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 84.3 m -103.58 14.84 30.35 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 -170.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.47 120.74 23.6 Favored Glycine 0 CA--C 1.535 1.303 0 O-C-N 121.411 -0.805 . . . . 0.0 111.711 176.235 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 80.0 0.59 85.93 Favored Glycine 0 CA--C 1.54 1.625 0 C-N-CA 124.533 1.063 . . . . 0.0 115.575 -174.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -80.39 158.07 26.11 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.42 1.61 . . . . 0.0 111.496 171.191 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 10.9 mp -46.69 -41.16 14.51 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.312 1.445 . . . . 0.0 112.336 169.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 98.6 mt -57.52 -43.39 84.26 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.028 0.931 . . . . 0.0 111.703 174.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -72.64 -36.74 58.26 Favored Glycine 0 CA--C 1.53 0.981 0 CA-C-O 118.499 -1.167 . . . . 0.0 113.42 178.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -62.56 -42.55 99.61 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 120.318 2.059 . . . . 0.0 110.425 173.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 30.9 tp -65.34 -50.44 65.62 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.314 1.046 . . . . 0.0 113.191 -179.139 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -95.06 -7.64 38.98 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 124.782 1.233 . . . . 0.0 112.611 -175.363 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 82.47 -28.05 3.54 Favored Glycine 0 CA--C 1.541 1.662 0 C-N-CA 125.795 1.664 . . . . 0.0 113.167 -169.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.48 136.51 6.4 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 129.01 2.924 . . . . 0.0 109.265 176.544 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -139.32 22.96 2.55 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 119.267 0.939 . . . . 0.0 112.218 177.512 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 14.7 m -84.78 129.59 34.8 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 179.46 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 5.1 p90 -159.29 171.26 20.15 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.854 -1.066 . . . . 0.0 112.251 -168.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 79.9 p -113.39 136.26 52.96 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 114.659 -1.155 . . . . 0.0 113.434 177.122 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 3.7 m -77.65 -9.86 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 N-CA-C 114.066 1.136 . . . . 0.0 114.066 -177.243 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -80.91 -8.73 59.81 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.859 1.664 . . . . 0.0 115.149 174.227 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 39.0 t0 -131.29 90.11 39.24 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 125.519 1.527 . . . . 0.0 111.197 -172.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -67.46 -27.39 39.76 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 123.595 2.863 . . . . 0.0 115.08 -174.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 66.0 m -61.11 -53.16 66.21 Favored Pre-proline 0 N--CA 1.476 0.872 0 N-CA-C 114.326 1.232 . . . . 0.0 114.326 -177.562 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -66.6 -31.64 40.5 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 122.364 2.043 . . . . 0.0 112.761 175.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 6.5 tp -60.98 -49.02 79.12 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.779 1.232 . . . . 0.0 111.093 173.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -59.03 -29.26 67.15 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 -176.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -68.78 -51.52 40.14 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.604 1.093 . . . . 0.0 111.822 177.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 3.4 ptt? -68.86 -29.52 67.84 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.021 0.928 . . . . 0.0 112.633 178.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 17.7 tp -76.15 -47.13 25.44 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 126.821 2.049 . . . . 0.0 111.44 179.409 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 74.5 mtt180 -57.34 -27.47 62.27 Favored 'General case' 0 N--CA 1.485 1.282 0 CA-C-N 120.379 1.445 . . . . 0.0 113.16 176.08 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 90.4 mttt -76.49 -24.02 53.79 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.511 1.525 . . . . 0.0 113.509 174.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 60.2 m-20 -112.64 -22.23 10.86 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -177.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.6 tt . . . . . 0 CA--C 1.543 0.678 0 C-N-CA 127.701 2.4 . . . . 0.0 108.265 -173.856 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 24.1 m . . . . . 0 N--CA 1.479 0.984 0 CA-C-O 120.238 0.066 . . . . 0.0 110.869 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 -79.7 144.55 60.72 Favored Pre-proline 0 N--CA 1.483 1.201 0 O-C-N 121.125 -0.984 . . . . 0.0 110.934 -172.525 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -73.12 176.71 8.75 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 123.542 2.828 . . . . 0.0 112.291 176.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -58.22 146.81 32.52 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.873 0.869 . . . . 0.0 110.054 173.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.1 mp -56.5 -46.41 99.82 Favored Pre-proline 0 N--CA 1.476 0.864 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -169.312 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -66.75 -25.27 46.4 Favored 'Trans proline' 0 C--N 1.351 0.687 0 CA-C-N 121.513 1.576 . . . . 0.0 113.706 176.007 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.1 tt -69.73 -40.84 75.97 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.235 0.925 . . . . 0.0 109.972 173.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 28.6 tp -59.6 -36.92 77.24 Favored 'General case' 0 CA--C 1.547 0.846 0 O-C-N 120.954 -1.091 . . . . 0.0 111.421 169.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 19.7 mmtp -67.1 -33.72 76.08 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 173.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 83.4 mt -62.29 -38.99 82.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 124.439 1.096 . . . . 0.0 111.728 170.687 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.7 mp -68.95 -37.22 78.73 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 120.076 1.307 . . . . 0.0 112.356 171.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 58.7 m170 -60.87 -43.55 98.26 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 119.22 0.918 . . . . 0.0 111.697 172.176 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.66 -23.44 67.26 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.939 1.296 . . . . 0.0 113.416 175.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.468 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -72.08 -6.7 44.33 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 123.711 0.804 . . . . 0.0 113.089 171.624 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.73 19.38 40.82 Favored Glycine 0 CA--C 1.536 1.351 0 C-N-CA 125.142 1.353 . . . . 0.0 114.712 178.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -126.24 145.27 50.47 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.868 1.267 . . . . 0.0 113.133 -175.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -74.5 153.6 39.05 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.915 0.886 . . . . 0.0 110.177 169.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -150.76 134.92 4.94 Favored Glycine 0 CA--C 1.529 0.922 0 N-CA-C 115.601 1.0 . . . . 0.0 115.601 179.479 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -148.88 78.57 1.4 Allowed 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 127.168 2.187 . . . . 0.0 108.847 173.592 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . 0.435 0.0 OUTLIER 64.87 141.01 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 129.536 3.134 . . . . 0.0 117.838 176.072 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -161.8 171.56 17.6 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 114.055 1.131 . . . . 0.0 114.055 -168.735 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 37.7 p -96.47 174.23 6.96 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 127.109 2.163 . . . . 0.0 112.523 169.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 15.9 t -50.19 -46.12 24.6 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 O-C-N 121.173 -0.954 . . . . 0.0 111.545 171.389 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -57.37 -38.51 74.33 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.752 0.821 . . . . 0.0 112.639 -176.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -80.51 -34.95 35.26 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.42 1.088 . . . . 0.0 112.948 176.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 73.2 t -72.79 -45.88 55.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 O-C-N 121.215 -0.928 . . . . 0.0 112.291 -179.759 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 22.3 mmt -64.59 -30.66 71.68 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-N 120.012 1.278 . . . . 0.0 112.643 -178.303 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 85.4 t60 -53.85 -53.75 48.18 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.431 173.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -74.61 -34.27 62.79 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 174.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -70.29 -43.72 69.82 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.775 1.17 . . . . 0.0 112.814 -179.411 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.98 -39.68 98.37 Favored Glycine 0 CA--C 1.531 1.084 0 CA-C-N 118.843 0.747 . . . . 0.0 111.873 173.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.2 tp60 -61.18 -48.09 83.16 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.667 1.187 . . . . 0.0 111.934 172.146 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.468 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 66.3 t80 -60.7 -50.07 74.95 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.811 0.844 . . . . 0.0 110.885 177.29 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 60.4 mt -61.76 -35.76 69.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 124.817 1.247 . . . . 0.0 111.26 179.006 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.2 tpt -65.53 -39.52 91.87 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.595 1.158 . . . . 0.0 112.514 171.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 84.3 t -78.32 -32.97 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 CA-C-N 119.336 0.971 . . . . 0.0 112.969 -179.065 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 47.8 mmtt -90.46 -15.53 30.68 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.021 1.329 . . . . 0.0 113.15 177.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.3 mp0 50.17 66.45 1.14 Allowed 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 127.295 2.238 . . . . 0.0 113.183 -173.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 51.5 mt -91.2 0.64 57.49 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.52 0.728 . . . . 0.0 112.901 177.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 54.4 p90 -89.3 157.49 18.18 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.945 1.298 . . . . 0.0 111.354 171.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -88.52 134.58 33.82 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 121.86 -0.525 . . . . 0.0 110.69 169.69 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.47 -21.34 65.39 Favored 'General case' 0 CA--C 1.544 0.727 0 O-C-N 120.893 -1.129 . . . . 0.0 113.689 172.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -82.69 -34.57 27.32 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.704 1.202 . . . . 0.0 111.101 -179.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -147.89 76.35 1.38 Allowed 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 128.035 2.534 . . . . 0.0 109.43 -169.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 26.3 mp0 -59.34 -23.56 62.61 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.299 -0.876 . . . . 0.0 113.003 -178.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 3.3 p-80 -66.12 -23.22 66.45 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 171.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 12.6 tpp -87.06 132.05 33.93 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.758 1.223 . . . . 0.0 110.092 170.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.7 t -124.41 112.09 30.99 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 C-N-CA 126.577 1.951 . . . . 0.0 108.968 -175.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 58.0 t80 -89.98 59.26 4.47 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.411 1.485 . . . . 0.0 111.468 -176.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 52.5 m -72.28 -4.51 30.06 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 120.832 -1.168 . . . . 0.0 113.021 171.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.3 -24.65 59.27 Favored Glycine 0 CA--C 1.541 1.682 0 CA-C-N 120.648 1.567 . . . . 0.0 113.819 169.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -91.1 6.54 81.5 Favored Glycine 0 CA--C 1.542 1.778 0 C-N-CA 125.528 1.537 . . . . 0.0 115.326 171.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -112.13 171.1 7.71 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.249 1.82 . . . . 0.0 112.494 -173.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.1 mp -47.16 -40.23 15.37 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.244 1.418 . . . . 0.0 111.969 169.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.1 tp -64.76 -32.22 73.81 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.879 0.872 . . . . 0.0 111.945 175.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -75.11 -35.09 50.38 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 126.515 2.007 . . . . 0.0 114.458 174.331 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -65.63 -42.62 91.29 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 119.791 1.796 . . . . 0.0 110.232 169.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 25.6 tp -60.59 -49.33 77.96 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.155 1.382 . . . . 0.0 112.588 179.29 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.34 -11.09 21.52 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 115.478 1.658 . . . . 0.0 115.478 -177.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.11 -18.81 8.95 Favored Glycine 0 CA--C 1.539 1.59 0 C-N-CA 125.843 1.687 . . . . 0.0 115.968 179.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.33 28.64 0.57 Allowed 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 115.018 1.488 . . . . 0.0 115.018 -175.617 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -70.66 46.34 0.09 Allowed 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 116.212 1.93 . . . . 0.0 116.212 -168.21 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 41.0 m -105.93 142.41 35.68 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 120.789 -1.194 . . . . 0.0 110.491 170.155 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -161.39 171.4 18.31 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 -168.126 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 3.5 m -121.92 136.26 54.92 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.247 1.019 . . . . 0.0 111.389 174.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 22.4 m -74.22 -21.65 17.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 C-N-CA 124.214 1.005 . . . . 0.0 113.707 -175.239 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -72.72 -8.58 56.06 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 125.335 1.454 . . . . 0.0 114.375 174.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 47.0 t0 -117.64 82.78 16.47 Favored Pre-proline 0 CA--C 1.547 0.851 0 C-N-CA 126.786 2.034 . . . . 0.0 109.097 -179.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -66.57 -31.9 40.25 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 123.478 2.785 . . . . 0.0 114.591 -169.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 55.7 m -56.7 -54.19 56.53 Favored Pre-proline 0 N--CA 1.476 0.856 0 CA-C-N 120.057 1.299 . . . . 0.0 113.949 -176.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -66.2 -28.52 47.98 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 122.071 1.847 . . . . 0.0 113.209 175.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 32.4 tp -69.61 -43.47 72.68 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.145 -0.972 . . . . 0.0 111.255 176.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -65.92 -34.3 77.8 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 121.496 -0.753 . . . . 0.0 112.329 171.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -63.08 -46.74 86.01 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.348 0.976 . . . . 0.0 112.578 175.006 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.488 ' HE3' ' HB2' ' A' ' 101' ' ' MET . 47.7 mtm -60.2 -49.92 75.73 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.244 0.618 . . . . 0.0 111.656 170.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 49.6 mt -59.92 -45.52 92.31 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-O 118.023 -0.989 . . . . 0.0 111.648 -176.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -55.09 -25.81 33.8 Favored 'General case' 0 N--CA 1.48 1.038 0 CA-C-N 119.926 1.239 . . . . 0.0 114.139 175.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -94.22 -16.77 23.34 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 125.322 1.449 . . . . 0.0 114.782 174.318 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 24.9 m-80 -117.95 -41.86 2.87 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-N 119.418 1.008 . . . . 0.0 113.598 -171.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 39.5 tp . . . . . 0 CA--C 1.54 0.565 0 C-N-CA 126.614 1.966 . . . . 0.0 107.971 169.561 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.1 m . . . . . 0 N--CA 1.477 0.908 0 CA-C-O 120.627 0.251 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 42.8 ttp180 -110.42 134.98 20.68 Favored Pre-proline 0 N--CA 1.479 0.987 0 C-N-CA 124.195 0.998 . . . . 0.0 112.914 -169.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.01 159.2 54.08 Favored 'Trans proline' 0 CA--C 1.537 0.637 0 C-N-CA 122.367 2.044 . . . . 0.0 111.788 169.575 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -55.55 161.19 2.12 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 115.027 1.492 . . . . 0.0 115.027 177.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 22.2 mt -61.15 -41.72 82.26 Favored Pre-proline 0 CA--C 1.548 0.881 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 -168.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -70.08 -30.76 20.28 Favored 'Trans proline' 0 C--N 1.355 0.871 0 C-N-CA 122.152 1.901 . . . . 0.0 112.763 169.557 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 tt -71.95 -43.87 64.5 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.795 1.238 . . . . 0.0 110.841 -175.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 23.8 tp -53.65 -37.28 62.97 Favored 'General case' 0 CA--C 1.548 0.899 0 O-C-N 120.98 -1.075 . . . . 0.0 111.801 171.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -72.41 -19.18 61.64 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.198 0.999 . . . . 0.0 113.695 177.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 84.7 mt -69.49 -41.72 80.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 CA-C-N 118.988 0.813 . . . . 0.0 109.074 168.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.4 mp -66.73 -35.92 81.25 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 121.564 -0.71 . . . . 0.0 110.913 175.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 50.6 m170 -60.85 -49.51 77.17 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 118.362 0.528 . . . . 0.0 111.535 169.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.18 -23.85 67.62 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.525 1.13 . . . . 0.0 113.903 177.535 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.402 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -67.43 -14.83 63.28 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.402 1.081 . . . . 0.0 113.066 173.107 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.74 22.52 10.98 Favored Glycine 0 CA--C 1.537 1.415 0 C-N-CA 125.26 1.41 . . . . 0.0 114.557 179.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -132.42 154.9 49.38 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.83 1.252 . . . . 0.0 113.581 -174.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.9 tt0 -77.39 152.35 34.42 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.718 0.807 . . . . 0.0 110.128 169.534 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -144.73 126.17 2.58 Favored Glycine 0 N--CA 1.469 0.88 0 N-CA-C 114.88 0.712 . . . . 0.0 114.88 178.545 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -151.06 78.35 1.29 Allowed 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 126.748 2.019 . . . . 0.0 108.931 173.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 30.7 mtm 67.18 140.86 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 129.668 3.187 . . . . 0.0 117.112 174.189 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -170.41 166.03 8.58 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.983 1.313 . . . . 0.0 113.489 -169.506 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 66.9 p -74.04 167.69 21.01 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 125.188 1.395 . . . . 0.0 111.497 168.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -59.63 -39.07 78.55 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.387 0 O-C-N 120.5 -1.375 . . . . 0.0 111.904 174.029 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -62.28 -44.04 97.44 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.716 1.606 . . . . 0.0 112.876 176.146 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -67.84 -37.46 81.91 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 121.908 -0.495 . . . . 0.0 111.857 172.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 33.3 t -61.5 -43.91 97.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 123.617 0.767 . . . . 0.0 111.317 173.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 19.4 ptp -73.08 -23.93 60.6 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 115.579 1.696 . . . . 0.0 115.579 -178.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 84.5 t60 -51.72 -44.04 63.07 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 118.73 0.695 . . . . 0.0 110.321 168.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 -74.79 -44.0 51.79 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 170.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.6 mp -67.25 -34.42 77.39 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 120.32 1.418 . . . . 0.0 113.873 -177.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.45 -47.37 87.98 Favored Glycine 0 CA--C 1.531 1.091 0 CA-C-N 119.222 0.919 . . . . 0.0 111.572 171.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 11.2 tp60 -54.93 -46.14 74.89 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.596 1.158 . . . . 0.0 111.604 171.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.402 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 68.8 t80 -62.55 -51.37 67.65 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.656 0.782 . . . . 0.0 110.828 179.826 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 67.8 mt -61.67 -37.24 77.51 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 123.758 0.823 . . . . 0.0 111.034 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 35.4 mmt -67.38 -42.45 83.36 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 174.043 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 6.6 p -78.54 -28.75 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 CA-C-N 119.869 1.213 . . . . 0.0 113.386 -177.246 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 57.4 mmtt -92.2 -15.83 27.04 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.905 1.282 . . . . 0.0 113.446 174.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 14.1 mp0 53.12 67.19 1.04 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.213 1.805 . . . . 0.0 113.06 -174.243 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.7 tp -90.31 3.83 52.51 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.34 1.056 . . . . 0.0 112.376 179.641 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 40.0 p90 -109.16 160.59 15.96 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 128.183 2.593 . . . . 0.0 110.725 178.194 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -94.54 130.71 40.84 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 109.273 -0.639 . . . . 0.0 109.273 168.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -57.03 -33.81 67.58 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 119.11 0.868 . . . . 0.0 112.737 -175.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -87.07 -15.13 39.48 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.873 0.869 . . . . 0.0 112.343 -172.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -141.97 57.47 1.48 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 127.875 2.47 . . . . 0.0 110.512 -176.303 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -60.31 -17.46 42.94 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 121.381 -0.824 . . . . 0.0 112.728 178.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 6.1 p-80 -63.42 -5.38 3.57 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.272 1.429 . . . . 0.0 114.332 169.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 48.1 mtp -128.35 150.75 49.96 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.97 1.259 . . . . 0.0 112.844 169.047 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 t -127.29 140.55 48.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 126.314 1.846 . . . . 0.0 108.243 175.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 86.1 m-85 -120.68 68.23 0.86 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.1 0.96 . . . . 0.0 112.622 -168.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 1.9 m -84.81 13.5 5.78 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 -170.269 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.82 -28.63 63.47 Favored Glycine 0 CA--C 1.541 1.705 0 O-C-N 120.473 -1.392 . . . . 0.0 114.663 178.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -94.15 5.95 72.04 Favored Glycine 0 CA--C 1.541 1.697 0 C-N-CA 125.358 1.456 . . . . 0.0 115.059 172.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -97.81 175.59 6.11 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.914 1.686 . . . . 0.0 112.53 -175.055 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 10.5 mp -59.56 -36.32 75.97 Favored 'General case' 0 CA--C 1.547 0.828 0 O-C-N 121.022 -1.048 . . . . 0.0 111.451 169.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 80.5 mt -57.64 -41.54 81.61 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.173 -0.954 . . . . 0.0 111.384 169.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -69.63 -35.3 74.11 Favored Glycine 0 CA--C 1.533 1.169 0 CA-C-O 118.709 -1.05 . . . . 0.0 113.821 176.084 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -72.94 -29.45 63.11 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 120.333 2.067 . . . . 0.0 111.477 176.398 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 29.2 tp -70.79 -50.47 35.4 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.104 1.362 . . . . 0.0 112.449 174.011 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.58 -6.4 23.9 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 124.628 1.171 . . . . 0.0 113.969 -171.182 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.47 -28.88 2.31 Favored Glycine 0 CA--C 1.54 1.647 0 C-N-CA 125.571 1.558 . . . . 0.0 113.759 -171.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.89 135.05 11.18 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 128.134 2.574 . . . . 0.0 110.005 176.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -148.54 42.75 0.99 Allowed 'General case' 0 N--CA 1.476 0.857 0 CA-C-O 122.283 1.039 . . . . 0.0 110.373 179.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 14.8 m -93.54 136.34 33.91 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 121.5 -0.75 . . . . 0.0 110.268 170.122 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 53.8 p90 -158.85 167.52 29.22 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.293 1.037 . . . . 0.0 113.497 -169.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 9.7 t -103.7 136.51 43.27 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.57 1.148 . . . . 0.0 111.468 170.29 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 5.5 m -77.83 -11.7 13.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 N-CA-C 114.859 1.429 . . . . 0.0 114.859 178.235 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 18.8 pttm -84.06 -8.53 59.09 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 115.26 1.578 . . . . 0.0 115.26 -176.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 42.2 t0 -120.58 96.22 48.93 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 126.148 1.779 . . . . 0.0 111.132 -169.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -60.37 -30.89 91.93 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 124.095 3.197 . . . . 0.0 115.315 -178.428 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 69.3 m -60.44 -55.02 49.24 Favored Pre-proline 0 N--CA 1.477 0.905 0 CA-C-N 120.264 1.393 . . . . 0.0 113.913 -177.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -67.1 -27.76 41.66 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 122.064 1.842 . . . . 0.0 112.795 175.182 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 46.4 mt -61.45 -53.95 49.84 Favored 'General case' 0 C--N 1.344 0.341 0 CA-C-N 119.155 0.889 . . . . 0.0 110.535 173.184 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -58.94 -39.38 81.46 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.122 0.873 . . . . 0.0 113.012 176.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -58.67 -49.19 78.48 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 118.763 0.71 . . . . 0.0 112.572 177.435 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 45.2 mtm -68.14 -47.38 68.25 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.249 0.62 . . . . 0.0 112.317 175.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 69.4 mt -54.52 -47.98 72.48 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.229 1.012 . . . . 0.0 111.034 -178.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -59.56 -22.07 61.2 Favored 'General case' 0 N--CA 1.482 1.165 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 175.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -88.42 -22.05 23.94 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 125.977 1.711 . . . . 0.0 113.727 173.559 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -111.26 -33.72 6.36 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -170.59 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 42.7 tp . . . . . 0 CA--C 1.54 0.57 0 C-N-CA 126.957 2.103 . . . . 0.0 108.938 169.137 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 . . . . . 0 CA--C 1.547 0.847 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -99.16 30.67 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.988 0 C-N-CA 126.941 2.096 . . . . 0.0 111.711 -176.497 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 53.9 t30 50.43 38.71 18.91 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 126.049 1.74 . . . . 0.0 113.32 -174.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 14.4 pm0 -85.02 168.61 14.76 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.067 1.747 . . . . 0.0 113.099 -173.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 31.1 m -110.1 172.07 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 C-N-CA 126.223 1.809 . . . . 0.0 112.941 -169.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 42.7 mtm180 -86.83 143.14 34.99 Favored Pre-proline 0 N--CA 1.48 1.055 0 O-C-N 121.304 -0.873 . . . . 0.0 111.862 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -81.48 -179.28 4.82 Favored 'Trans proline' 0 CA--C 1.535 0.529 0 C-N-CA 124.371 3.381 . . . . 0.0 112.447 173.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.9 ttmt -70.38 149.68 47.05 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.034 0.534 . . . . 0.0 109.932 175.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 85.4 mt -62.44 -41.76 75.8 Favored Pre-proline 0 N--CA 1.478 0.933 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 -168.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -63.33 -29.81 72.76 Favored 'Trans proline' 0 C--N 1.349 0.582 0 CA-C-N 121.58 1.6 . . . . 0.0 114.001 171.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 7.9 tp -64.68 -42.01 95.66 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 119.591 1.087 . . . . 0.0 110.549 172.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.1 tt -64.34 -35.09 79.73 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.012 0.925 . . . . 0.0 111.792 174.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -66.3 -41.39 89.83 Favored 'General case' 0 N--CA 1.483 1.219 0 O-C-N 120.954 -1.091 . . . . 0.0 113.089 170.159 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 74.5 mt -62.46 -39.0 82.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 CA-C-N 119.413 1.006 . . . . 0.0 111.179 173.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 52.4 mt -65.3 -42.12 93.4 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.083 0.953 . . . . 0.0 111.919 173.538 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 34.4 m170 -61.56 -41.13 96.93 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.15 -0.969 . . . . 0.0 112.172 171.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.54 -27.52 69.02 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.89 0.876 . . . . 0.0 112.964 176.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.449 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -74.66 -3.55 31.98 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.303 1.041 . . . . 0.0 113.515 172.157 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 92.28 6.83 64.3 Favored Glycine 0 CA--C 1.537 1.449 0 C-N-CA 125.542 1.544 . . . . 0.0 114.821 -178.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -85.49 168.34 14.63 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 118.745 1.272 . . . . 0.0 113.327 179.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 22.2 tm0? -135.36 140.89 45.39 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.712 1.605 . . . . 0.0 108.157 168.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 175.03 172.93 40.39 Favored Glycine 0 CA--C 1.526 0.73 0 N-CA-C 115.512 0.965 . . . . 0.0 115.512 -176.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -133.23 -58.25 0.9 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 126.227 1.811 . . . . 0.0 109.889 173.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 21.5 mtm -95.62 137.26 34.93 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.049 1.739 . . . . 0.0 111.568 175.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 84.6 m-85 -150.45 138.4 20.08 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.719 1.208 . . . . 0.0 112.532 -178.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 51.1 p -81.94 169.57 16.63 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.164 0.986 . . . . 0.0 110.477 168.172 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -56.39 -36.59 47.51 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 O-C-N 120.459 -1.401 . . . . 0.0 111.434 172.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 54.9 tptt -68.03 -44.79 75.68 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.726 1.211 . . . . 0.0 112.56 176.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 58.5 mt-10 -66.1 -36.81 84.16 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.206 0.602 . . . . 0.0 112.014 176.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 66.8 t -61.87 -50.37 80.43 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 C-N-CA 123.25 0.62 . . . . 0.0 110.409 170.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.35 -39.16 93.78 Favored 'General case' 0 C--N 1.334 -0.094 0 C-N-CA 126.261 1.824 . . . . 0.0 114.279 -172.338 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 83.1 t60 -51.59 -52.57 46.44 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 122.732 0.413 . . . . 0.0 111.309 174.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -74.79 -32.68 62.07 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 115.103 1.519 . . . . 0.0 115.103 174.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -70.25 -40.68 74.28 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 120.779 1.627 . . . . 0.0 112.89 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -60.62 -47.35 91.59 Favored Glycine 0 CA--C 1.53 0.978 0 N-CA-C 110.914 -0.875 . . . . 0.0 110.914 171.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 11.6 tp60 -57.17 -42.37 80.98 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.296 1.038 . . . . 0.0 112.503 173.22 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.449 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 71.3 t80 -63.96 -51.54 63.87 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.817 1.247 . . . . 0.0 110.784 178.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 37.1 mt -61.66 -37.74 78.69 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 C-N-CA 123.869 0.868 . . . . 0.0 110.793 178.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 34.9 mmt -66.73 -43.16 84.93 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 174.047 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 7.4 p -78.49 -28.6 14.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 CA-C-N 119.894 1.225 . . . . 0.0 113.386 -176.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 20.2 mmtp -91.13 -15.81 28.81 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.052 1.341 . . . . 0.0 113.458 173.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 14.6 mp0 54.18 63.34 2.21 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.078 1.751 . . . . 0.0 112.707 -174.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 13.6 tp -92.3 12.59 21.97 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.047 1.339 . . . . 0.0 111.961 -178.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 32.9 p90 -123.02 160.68 25.8 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 128.482 2.713 . . . . 0.0 110.625 -177.115 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.2 t0 -92.82 128.61 38.75 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 169.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.27 -30.95 52.4 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 179.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -94.11 -16.41 23.8 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.004 1.322 . . . . 0.0 112.559 -172.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -139.57 59.46 1.59 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 127.43 2.292 . . . . 0.0 109.83 -177.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -63.23 -17.75 62.79 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.526 0.73 . . . . 0.0 111.961 -178.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 6.4 p-80 -63.91 -1.39 1.41 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.353 1.461 . . . . 0.0 113.429 168.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 36.3 mtp -128.03 145.43 50.99 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 120.293 1.406 . . . . 0.0 111.618 168.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.7 t -127.36 140.26 49.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 125.484 1.514 . . . . 0.0 108.208 173.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 -112.74 52.61 0.77 Allowed 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.378 1.071 . . . . 0.0 113.818 -168.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 32.6 m -70.5 1.73 4.78 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -176.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.57 -25.45 55.36 Favored Glycine 0 CA--C 1.541 1.69 0 CA-C-N 120.558 1.527 . . . . 0.0 114.185 169.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -89.26 5.87 83.86 Favored Glycine 0 CA--C 1.542 1.727 0 C-N-CA 125.375 1.464 . . . . 0.0 115.327 171.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -109.46 172.36 6.9 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.335 1.854 . . . . 0.0 112.058 -174.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 88.5 mt -55.02 -35.62 64.62 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 120.986 -1.071 . . . . 0.0 112.352 169.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.1 tp -60.46 -42.58 96.49 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.738 0.815 . . . . 0.0 111.116 174.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -65.92 -44.36 91.95 Favored Glycine 0 CA--C 1.529 0.937 0 C-N-CA 125.378 1.466 . . . . 0.0 113.627 172.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.2 -26.91 65.96 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.376 1.588 . . . . 0.0 112.356 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 28.2 tp -71.83 -54.56 9.77 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.036 1.334 . . . . 0.0 111.996 169.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -88.64 -5.15 58.34 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-N 118.771 0.714 . . . . 0.0 112.71 -170.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 78.69 -27.89 2.17 Favored Glycine 0 CA--C 1.54 1.605 0 C-N-CA 126.131 1.824 . . . . 0.0 113.291 -170.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.81 134.85 9.0 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 128.28 2.632 . . . . 0.0 109.741 176.317 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -145.17 28.39 1.22 Allowed 'General case' 0 N--CA 1.476 0.863 0 O-C-N 121.3 -0.875 . . . . 0.0 110.876 174.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 14.9 m -87.92 135.61 33.33 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 121.59 -0.694 . . . . 0.0 109.387 170.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 17.5 p90 -158.26 168.75 26.18 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 123.84 0.856 . . . . 0.0 113.215 -169.255 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 14.9 t -110.26 136.19 49.84 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 122.373 1.082 . . . . 0.0 112.217 170.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -78.09 -13.66 13.93 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-N 114.08 -1.418 . . . . 0.0 114.115 -171.321 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 47.5 pttt -81.26 -7.31 59.55 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 125.867 1.667 . . . . 0.0 115.034 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -119.36 85.22 30.66 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 126.07 1.748 . . . . 0.0 110.828 -172.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.25 -27.32 56.15 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.953 3.102 . . . . 0.0 115.261 -172.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 68.2 m -63.59 -55.89 30.8 Favored Pre-proline 0 N--CA 1.478 0.928 0 CA-C-N 119.924 1.238 . . . . 0.0 114.036 -177.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -66.81 -29.55 42.01 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 121.872 1.715 . . . . 0.0 112.341 175.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 25.4 tp -65.48 -43.05 91.46 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.069 0.948 . . . . 0.0 111.583 176.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -60.49 -39.56 88.14 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 121.702 -0.624 . . . . 0.0 111.968 173.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -61.68 -43.28 99.16 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.244 0.618 . . . . 0.0 112.521 176.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 38.2 mtm -64.04 -49.83 70.84 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 173.059 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 65.7 mt -53.25 -48.16 68.46 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.886 1.274 . . . . 0.0 110.855 177.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.64 -18.51 12.38 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.745 1.618 . . . . 0.0 114.881 176.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -96.9 -22.51 16.84 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 125.955 1.702 . . . . 0.0 114.0 172.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -105.28 -26.98 11.79 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 119.818 1.19 . . . . 0.0 113.808 -175.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 3.0 tt -113.94 105.99 13.9 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.817 1.647 . . . . 0.0 106.937 169.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 44.9 t -61.31 125.23 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 C-N-CA 123.626 0.77 . . . . 0.0 110.405 -172.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 1.7 t -152.64 -174.33 4.87 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.597 1.159 . . . . 0.0 111.771 -177.119 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -75.44 -144.14 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.893 2.077 . . . . 0.0 110.594 171.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . 65.83 170.66 0.22 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 125.89 1.676 . . . . 0.0 115.306 -177.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 19.9 p . . . . . 0 N--CA 1.482 1.134 0 C-N-CA 127.124 2.17 . . . . 0.0 113.788 -177.457 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 200' ' ' 44Z . . . . . 0.43 ' CD3' ' CG1' ' A' ' 200' ' ' 44Z . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 21.8 pt20 . . . . . 0 CA--C 1.544 0.749 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -121.06 149.96 24.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 125.601 1.56 . . . . 0.0 110.222 -179.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -77.83 56.77 1.58 Allowed 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 124.991 1.317 . . . . 0.0 112.016 175.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -138.38 -179.4 5.78 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 128.092 2.557 . . . . 0.0 110.529 -170.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 23.6 m -103.73 156.29 5.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 124.759 1.224 . . . . 0.0 111.778 -176.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 30.8 ttt180 -101.31 123.24 45.41 Favored Pre-proline 0 N--CA 1.476 0.848 0 C-N-CA 124.651 1.181 . . . . 0.0 110.503 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.0 162.31 40.48 Favored 'Trans proline' 0 CA--C 1.535 0.553 0 C-N-CA 123.061 2.507 . . . . 0.0 113.197 170.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.3 tpmt? -61.38 150.42 35.3 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.476 1.11 . . . . 0.0 110.121 175.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 88.3 mt -60.73 -41.6 83.36 Favored Pre-proline 0 N--CA 1.478 0.936 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -170.28 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -65.09 -26.7 57.68 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 121.952 1.768 . . . . 0.0 114.02 172.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.2 tt -72.49 -45.91 57.24 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.06 0.944 . . . . 0.0 109.988 172.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.3 tt -57.79 -33.57 68.69 Favored 'General case' 0 N--CA 1.477 0.919 0 O-C-N 120.782 -1.199 . . . . 0.0 112.237 173.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.75 -28.14 69.76 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 113.742 1.015 . . . . 0.0 113.742 170.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 68.8 mt -67.33 -45.93 84.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 CA-C-N 119.74 1.155 . . . . 0.0 110.319 171.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.03 -40.66 90.08 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.275 0.63 . . . . 0.0 111.015 176.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 26.8 m170 -64.99 -42.74 94.25 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.758 -0.589 . . . . 0.0 112.51 173.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.34 -28.97 70.07 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.15 -0.969 . . . . 0.0 112.983 176.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.442 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -73.46 -6.08 44.1 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.428 1.091 . . . . 0.0 113.308 172.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.66 7.58 64.67 Favored Glycine 0 CA--C 1.537 1.464 0 C-N-CA 125.374 1.464 . . . . 0.0 115.129 -179.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -88.21 167.58 13.47 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 118.752 1.276 . . . . 0.0 112.745 177.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.8 tm0? -126.71 141.78 51.74 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.286 1.434 . . . . 0.0 109.551 169.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 174.92 167.5 34.29 Favored Glycine 0 N--CA 1.465 0.629 0 N-CA-C 114.726 0.65 . . . . 0.0 114.726 -178.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -126.8 -59.68 1.26 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.57 1.548 . . . . 0.0 109.734 170.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.0 mpp? -93.72 139.98 30.19 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 126.079 1.752 . . . . 0.0 111.126 170.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -146.53 138.97 25.08 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.425 1.49 . . . . 0.0 111.506 178.083 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 41.1 p -74.25 170.52 15.41 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 121.274 -0.891 . . . . 0.0 110.911 168.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.9 t -55.43 -40.53 58.39 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 120.349 -1.469 . . . . 0.0 110.891 169.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -66.96 -43.63 82.63 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.314 1.046 . . . . 0.0 112.695 179.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 64.6 mt-10 -69.79 -33.48 72.44 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 176.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 52.2 t -61.93 -54.87 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 CA-C-N 118.663 0.665 . . . . 0.0 109.49 169.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.3 ttm -61.75 -37.26 83.6 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 126.941 2.096 . . . . 0.0 114.586 -173.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -51.7 -55.19 21.01 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.154 0.582 . . . . 0.0 111.827 172.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 60.0 m-85 -74.82 -30.0 61.25 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 174.338 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -71.67 -39.65 70.15 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 120.277 1.399 . . . . 0.0 112.677 -179.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.16 -39.87 98.21 Favored Glycine 0 CA--C 1.533 1.202 0 CA-C-N 119.395 0.998 . . . . 0.0 111.959 171.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 9.9 tp60 -64.57 -45.74 85.78 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.023 1.329 . . . . 0.0 112.215 172.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.442 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 57.2 t80 -61.35 -49.54 76.55 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 124.21 1.004 . . . . 0.0 109.901 178.125 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 56.7 mt -64.38 -33.63 64.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 C-N-CA 124.322 1.049 . . . . 0.0 111.032 178.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 5.5 tpt -63.46 -39.23 93.9 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 120.23 1.377 . . . . 0.0 112.127 169.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 99.3 t -78.17 -41.53 26.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 O-C-N 120.429 -1.419 . . . . 0.0 112.584 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 52.7 mmtt -85.97 -15.71 40.66 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.082 1.353 . . . . 0.0 112.654 -176.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 48.02 81.29 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 128.558 2.743 . . . . 0.0 114.307 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 37.0 mt -101.86 8.71 41.17 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 125.194 1.398 . . . . 0.0 113.381 -177.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 50.3 p90 -122.58 164.02 18.94 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.325 1.85 . . . . 0.0 111.456 -175.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -91.32 133.46 35.41 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.79 -0.569 . . . . 0.0 111.369 174.232 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.2 -20.92 60.85 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 120.902 -1.124 . . . . 0.0 113.902 173.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -81.79 -32.03 31.53 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.543 1.137 . . . . 0.0 111.157 179.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -146.2 74.4 1.37 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 127.604 2.361 . . . . 0.0 110.311 -169.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 29.1 mp0 -60.41 -23.9 64.73 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 120.859 -1.151 . . . . 0.0 112.58 178.126 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 5.6 p-80 -67.4 -6.91 21.28 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.385 1.474 . . . . 0.0 114.502 171.065 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 1.9 tpt -111.98 126.77 55.5 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 126.749 2.02 . . . . 0.0 109.726 173.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.4 t -126.07 133.77 68.1 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.766 1.227 . . . . 0.0 110.062 -178.113 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -118.51 100.12 7.25 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.929 1.692 . . . . 0.0 109.086 173.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 61.4 m -99.43 14.51 29.51 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.509 0.724 . . . . 0.0 112.737 175.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.19 -27.25 68.77 Favored Glycine 0 CA--C 1.538 1.527 0 O-C-N 120.639 -1.288 . . . . 0.0 114.518 -177.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -90.03 4.61 83.17 Favored Glycine 0 CA--C 1.54 1.639 0 C-N-CA 125.145 1.355 . . . . 0.0 114.995 172.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -106.89 172.01 7.05 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.772 1.629 . . . . 0.0 112.669 -174.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 10.9 mp -53.45 -34.12 56.68 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.396 1.478 . . . . 0.0 112.663 169.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 98.7 mt -61.08 -47.15 87.67 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 121.111 -0.993 . . . . 0.0 111.654 170.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -63.3 -38.6 96.7 Favored Glycine 0 CA--C 1.533 1.171 0 CA-C-O 119.16 -0.8 . . . . 0.0 112.889 173.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.65 -29.66 62.47 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 119.715 1.758 . . . . 0.0 112.973 -179.497 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.1 pp -81.4 -34.72 31.45 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 175.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -100.4 -9.68 21.96 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 119.17 0.895 . . . . 0.0 113.15 -177.404 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.49 -27.1 3.33 Favored Glycine 0 CA--C 1.54 1.634 0 C-N-CA 125.525 1.536 . . . . 0.0 112.905 -169.298 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.68 138.36 6.05 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 128.032 2.533 . . . . 0.0 111.282 178.512 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -144.21 69.2 1.27 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.836 0.854 . . . . 0.0 109.149 168.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -105.02 124.88 50.3 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 169.421 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 49.8 p90 -157.22 156.03 31.85 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.18 0.992 . . . . 0.0 112.118 -169.32 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 10.5 m -107.65 135.8 48.48 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.076 171.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . 0.264 0.2 OUTLIER -78.23 -14.5 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 -169.412 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -75.5 -7.9 55.33 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 125.562 1.545 . . . . 0.0 114.832 174.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -116.67 95.35 45.97 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 126.719 2.008 . . . . 0.0 110.334 -172.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -62.45 -28.36 77.91 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.965 3.11 . . . . 0.0 115.249 -178.039 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 67.3 m -58.85 -53.89 61.84 Favored Pre-proline 0 N--CA 1.477 0.885 0 CA-C-N 120.121 1.328 . . . . 0.0 113.834 -178.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -65.52 -28.31 53.56 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 122.099 1.866 . . . . 0.0 113.187 174.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.54 HD22 ' CE3' ' A' ' 200' ' ' 44Z . 49.4 mt -62.92 -50.89 69.07 Favored 'General case' 0 C--N 1.344 0.356 0 CA-C-N 119.6 1.091 . . . . 0.0 111.13 174.009 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -60.48 -40.84 92.76 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 118.883 -0.579 . . . . 0.0 112.146 174.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -61.46 -49.65 75.97 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 119.229 0.922 . . . . 0.0 112.845 179.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 31.4 mtm -60.78 -49.64 76.67 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.657 0.783 . . . . 0.0 112.211 175.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 10.2 mp -65.97 -42.38 89.96 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 118.542 -0.742 . . . . 0.0 111.814 -176.433 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -57.28 -20.27 27.0 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 119.835 1.198 . . . . 0.0 113.842 172.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 90.4 mttt -95.84 -13.87 23.68 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.77 1.628 . . . . 0.0 114.404 174.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 8.1 p-10 -124.8 -16.33 6.21 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 116.154 1.909 . . . . 0.0 116.154 -178.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 57.4 tp -119.86 137.7 53.84 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 127.358 2.263 . . . . 0.0 108.858 176.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 91.4 t -68.73 104.57 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 173.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 4.8 t -156.98 -179.56 8.34 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.722 1.609 . . . . 0.0 110.975 -178.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -97.29 160.43 14.33 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.743 1.217 . . . . 0.0 113.466 -172.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -101.57 174.97 5.72 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.817 2.047 . . . . 0.0 114.024 -169.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 13.0 t . . . . . 0 N--CA 1.483 1.218 0 C-N-CA 127.271 2.229 . . . . 0.0 114.865 177.817 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 200' ' ' 44Z . . . . . 0.54 ' CE3' HD22 ' A' ' 98' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 . . . . . 0 CA--C 1.543 0.693 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.1 mt -130.31 14.89 2.22 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 125.052 1.341 . . . . 0.0 111.392 -175.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 49.46 39.02 15.69 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 126.115 1.766 . . . . 0.0 113.032 -175.446 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.1 pm0 -82.52 179.18 7.88 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.237 1.415 . . . . 0.0 113.708 -172.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 32.6 m -117.37 172.06 5.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 C-N-CA 126.744 2.017 . . . . 0.0 111.847 -175.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 24.0 ttp-105 -99.49 134.47 21.15 Favored Pre-proline 0 N--CA 1.481 1.111 0 O-C-N 120.847 -1.158 . . . . 0.0 111.802 178.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -71.46 171.29 16.51 Favored 'Trans proline' 0 C--N 1.354 0.832 0 C-N-CA 123.624 2.883 . . . . 0.0 112.65 175.437 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.6 tpmt? -62.01 146.66 49.52 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.251 1.02 . . . . 0.0 110.739 178.271 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 90.2 mt -55.3 -49.22 93.64 Favored Pre-proline 0 N--CA 1.474 0.769 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 -173.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -65.11 -21.09 63.22 Favored 'Trans proline' 0 CA--C 1.54 0.807 0 CA-C-N 122.034 1.762 . . . . 0.0 113.856 177.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.2 tt -75.72 -46.36 31.52 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.247 0.93 . . . . 0.0 109.657 169.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.1 tp -57.01 -34.62 68.36 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.246 -0.909 . . . . 0.0 113.285 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -64.3 -22.4 66.94 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 121.271 -0.893 . . . . 0.0 113.34 175.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 51.7 mt -70.23 -39.67 77.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 123.93 0.892 . . . . 0.0 110.363 171.595 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.9 mp -70.01 -35.37 74.31 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.347 -0.846 . . . . 0.0 111.279 175.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 57.7 m170 -61.03 -46.32 91.23 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 118.208 0.458 . . . . 0.0 111.263 169.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.65 -24.68 67.89 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 175.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.415 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -71.58 -6.31 39.81 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 172.054 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.72 17.59 47.98 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 125.039 1.304 . . . . 0.0 115.069 177.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -121.13 150.01 41.91 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.043 1.337 . . . . 0.0 112.71 -179.08 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -74.46 171.12 14.34 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.486 0.714 . . . . 0.0 111.548 169.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -169.06 133.1 2.74 Favored Glycine 0 C--N 1.341 0.817 0 N-CA-C 117.487 1.755 . . . . 0.0 117.487 -178.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -140.56 -13.41 0.99 Allowed 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 173.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 3.2 mtm -171.04 134.08 0.92 Allowed 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 126.539 1.936 . . . . 0.0 111.391 -175.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -155.1 147.5 24.0 Favored 'General case' 0 CA--C 1.55 0.974 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 -173.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 50.7 p -94.97 171.84 8.51 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 127.106 2.162 . . . . 0.0 110.371 168.234 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -52.09 -48.02 42.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 CA-C-N 120.356 1.435 . . . . 0.0 110.428 169.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -53.32 -37.84 62.65 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.114 0.966 . . . . 0.0 113.091 -179.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -80.82 -42.98 20.75 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.248 1.019 . . . . 0.0 112.726 176.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 75.6 t -64.18 -48.32 86.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 O-C-N 120.851 -1.156 . . . . 0.0 111.775 -179.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.4 mmm -72.66 -25.8 61.4 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 118.906 0.775 . . . . 0.0 112.421 -174.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 77.1 t60 -60.56 -54.52 44.44 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.678 0.791 . . . . 0.0 110.804 169.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 53.6 m-85 -72.37 -32.62 66.58 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 113.58 0.955 . . . . 0.0 113.58 179.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.9 mp -69.91 -40.64 75.48 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.882 1.219 . . . . 0.0 112.197 172.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.22 -42.91 99.72 Favored Glycine 0 CA--C 1.529 0.959 0 CA-C-N 118.979 0.809 . . . . 0.0 111.847 172.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.7 tp60 -58.52 -47.03 85.51 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.554 1.141 . . . . 0.0 111.973 171.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.415 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 28.3 t80 -60.7 -49.59 76.9 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.323 0.649 . . . . 0.0 110.752 175.799 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 54.6 mt -57.68 -37.83 61.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 124.868 1.267 . . . . 0.0 111.125 177.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -69.24 -37.56 78.05 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.876 0.87 . . . . 0.0 113.136 174.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 81.4 t -78.23 -31.5 16.34 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 124.179 0.992 . . . . 0.0 112.524 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 54.3 mmtt -92.34 -14.72 28.32 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.894 1.278 . . . . 0.0 113.152 176.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.7 mp0 53.61 61.16 3.24 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.467 1.907 . . . . 0.0 113.134 -172.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.4 mp -95.69 6.16 49.62 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.003 1.321 . . . . 0.0 113.539 -179.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 52.4 p90 -89.88 158.95 17.2 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.823 1.649 . . . . 0.0 110.691 169.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -85.27 123.37 30.67 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.589 -0.694 . . . . 0.0 110.904 170.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.4 -22.07 66.74 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 120.895 -1.128 . . . . 0.0 112.865 178.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 48.2 mm-40 -78.7 -26.94 44.92 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.357 -0.839 . . . . 0.0 111.035 -176.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -160.25 83.71 0.71 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 127.189 2.196 . . . . 0.0 110.906 -171.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -60.58 -14.24 18.96 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.626 1.57 . . . . 0.0 115.089 -169.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 22.6 p80 -65.31 -23.44 67.02 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 118.112 -0.947 . . . . 0.0 113.082 171.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 42.3 mmm -83.88 139.91 32.32 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 119.67 1.123 . . . . 0.0 112.843 173.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 60.4 t -120.86 133.45 67.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 127.794 2.437 . . . . 0.0 107.0 169.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 10.5 t80 -121.38 13.34 11.04 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 116.833 2.161 . . . . 0.0 116.833 -168.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 15.9 p 39.06 31.33 0.05 OUTLIER 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 128.407 2.683 . . . . 0.0 117.542 175.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.34 108.34 1.89 Allowed Glycine 0 CA--C 1.534 1.269 0 O-C-N 120.897 -1.127 . . . . 0.0 113.348 -171.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 68.45 14.06 66.29 Favored Glycine 0 CA--C 1.54 1.62 0 C-N-CA 124.21 0.91 . . . . 0.0 114.895 -175.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -75.45 155.27 36.45 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 118.682 1.241 . . . . 0.0 112.265 -177.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 81.8 mt -62.53 -32.5 73.46 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.412 1.485 . . . . 0.0 111.56 169.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 84.8 mt -54.81 -48.04 73.3 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.7 0.8 . . . . 0.0 111.354 171.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -71.78 -38.76 60.66 Favored Glycine 0 CA--C 1.53 0.976 0 C-N-CA 124.42 1.009 . . . . 0.0 112.989 178.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.93 -26.62 65.17 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 119.673 1.736 . . . . 0.0 112.481 177.457 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 47.7 tp -76.12 -56.32 4.76 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.397 1.479 . . . . 0.0 112.181 173.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.31 -7.73 41.01 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 113.469 0.915 . . . . 0.0 113.469 -169.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 80.66 -25.64 3.34 Favored Glycine 0 CA--C 1.539 1.558 0 C-N-CA 125.756 1.646 . . . . 0.0 113.34 -169.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.6 137.2 11.03 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 126.801 2.041 . . . . 0.0 112.058 178.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -148.14 49.06 1.05 Allowed 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.686 1.195 . . . . 0.0 110.429 168.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 8.1 p -89.85 137.53 32.26 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 121.327 -0.858 . . . . 0.0 110.063 169.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 46.6 p90 -171.82 167.95 6.2 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.519 0.728 . . . . 0.0 112.064 -169.151 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 60.2 p -121.21 143.83 48.93 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.071 -0.968 . . . . 0.0 113.51 173.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.505 HG21 ' CE5' ' A' ' 200' ' ' 44Z . 27.1 m -74.39 -12.86 15.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 -179.218 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.39 -0.48 46.2 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.778 1.631 . . . . 0.0 114.586 170.5 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 40.8 t0 -126.85 77.39 74.65 Favored Pre-proline 0 CA--C 1.551 1.015 0 C-N-CA 127.135 2.174 . . . . 0.0 109.95 171.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_exo -56.64 -40.88 81.33 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 124.623 3.549 . . . . 0.0 114.882 -175.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 55.6 m -52.92 -54.86 39.24 Favored Pre-proline 0 N--CA 1.476 0.848 0 N-CA-C 114.838 1.421 . . . . 0.0 114.838 -172.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -65.81 -30.46 49.62 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 122.336 2.024 . . . . 0.0 113.425 175.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.45 ' HA ' ' HE2' ' A' ' 101' ' ' MET . 37.0 tp -66.95 -47.28 72.13 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.003 0.921 . . . . 0.0 110.672 176.103 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -58.23 -40.53 81.93 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.721 0.808 . . . . 0.0 112.228 171.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -60.11 -51.04 71.31 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 119.729 1.15 . . . . 0.0 112.902 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.45 ' HE2' ' HA ' ' A' ' 98' ' ' LEU . 64.7 mtm -63.6 -44.5 93.8 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.034 0.534 . . . . 0.0 112.116 175.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 66.4 mt -61.5 -46.74 88.73 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-O 117.732 -1.128 . . . . 0.0 111.326 178.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 42.1 ttt180 -56.37 -24.98 47.9 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 121.265 1.848 . . . . 0.0 113.547 174.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -85.17 -17.9 35.77 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.561 1.544 . . . . 0.0 114.012 174.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -123.36 -6.39 8.22 Favored 'General case' 0 CA--C 1.558 1.273 0 N-CA-C 115.698 1.74 . . . . 0.0 115.698 178.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 68.8 tp -142.51 144.94 33.19 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 128.512 2.725 . . . . 0.0 109.679 -174.079 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 41.8 t -75.97 96.15 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 172.075 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 6.3 t -152.2 -174.62 4.94 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.404 1.482 . . . . 0.0 111.584 -177.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -101.52 175.58 5.52 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.467 1.907 . . . . 0.0 112.395 -171.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -109.13 -169.55 1.5 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.839 1.656 . . . . 0.0 112.999 -177.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 54.4 p . . . . . 0 N--CA 1.475 0.785 0 C-N-CA 126.137 1.775 . . . . 0.0 113.66 177.023 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 200' ' ' 44Z . . . . . 0.505 ' CE5' HG21 ' A' ' 92' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 . . . . . 0 CA--C 1.543 0.706 0 N-CA-C 112.292 0.478 . . . . 0.0 112.292 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 50.9 mt -129.09 136.95 58.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 125.408 1.483 . . . . 0.0 110.492 -175.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.0 t30 -112.0 123.39 50.16 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.456 1.502 . . . . 0.0 108.856 169.334 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.1 pm0 -147.2 -179.68 7.0 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 -168.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 33.7 m -104.14 172.18 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 C-N-CA 127.126 2.17 . . . . 0.0 111.656 175.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.3 ttp-105 -95.42 133.66 25.55 Favored Pre-proline 0 N--CA 1.48 1.037 0 O-C-N 120.991 -1.068 . . . . 0.0 111.522 172.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -68.38 171.44 12.88 Favored 'Trans proline' 0 C--N 1.354 0.857 0 C-N-CA 123.799 3.0 . . . . 0.0 113.501 176.05 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.5 ttmt -62.86 149.62 43.9 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.142 0.977 . . . . 0.0 110.685 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 81.3 mt -61.66 -43.11 87.12 Favored Pre-proline 0 N--CA 1.476 0.866 0 N-CA-C 115.062 1.504 . . . . 0.0 115.062 -168.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -65.0 -28.41 57.66 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.035 1.824 . . . . 0.0 113.752 172.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 5.1 tt -67.49 -49.19 64.63 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 119.221 0.919 . . . . 0.0 109.499 172.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 13.9 tp -60.24 -33.07 71.77 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 121.294 -0.879 . . . . 0.0 112.784 177.41 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -58.66 -27.69 65.02 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 174.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 60.0 mt -72.99 -39.13 57.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.17 0.988 . . . . 0.0 110.998 175.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.3 mp -68.08 -34.85 77.19 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.477 -0.764 . . . . 0.0 110.953 174.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 60.4 m170 -61.94 -44.58 96.47 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 121.998 -0.439 . . . . 0.0 111.513 169.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -65.02 -26.99 68.51 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 175.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.33 -3.41 26.97 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.352 1.061 . . . . 0.0 113.435 171.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.67 15.26 57.02 Favored Glycine 0 CA--C 1.535 1.317 0 C-N-CA 125.021 1.296 . . . . 0.0 115.309 174.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -117.13 145.34 43.86 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.943 1.297 . . . . 0.0 112.551 -179.114 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -75.06 170.69 15.51 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.255 0.622 . . . . 0.0 111.329 169.461 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -173.0 143.74 7.44 Favored Glycine 0 C--N 1.34 0.765 0 N-CA-C 117.324 1.69 . . . . 0.0 117.324 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -140.7 -11.22 1.02 Allowed 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 175.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.5 mtm -169.68 130.18 1.03 Allowed 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 125.744 1.618 . . . . 0.0 111.579 -175.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -155.82 139.5 16.06 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -175.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 64.8 p -80.77 176.02 10.17 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.792 0.837 . . . . 0.0 109.646 166.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -59.34 -37.64 70.41 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.324 0 O-C-N 120.262 -1.524 . . . . 0.0 111.651 172.381 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -66.97 -42.19 85.57 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.865 1.666 . . . . 0.0 113.059 175.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -70.34 -35.06 73.36 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.776 -0.577 . . . . 0.0 112.094 174.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 18.7 t -60.38 -48.91 86.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 124.085 0.954 . . . . 0.0 110.844 169.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -62.34 -36.43 82.16 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 127.097 2.159 . . . . 0.0 114.178 -173.176 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -51.7 -53.02 43.74 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 122.857 0.463 . . . . 0.0 111.956 170.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -74.7 -31.66 61.94 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 114.296 1.221 . . . . 0.0 114.296 175.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -72.14 -41.93 66.58 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.971 1.26 . . . . 0.0 112.876 -179.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -60.46 -42.94 99.22 Favored Glycine 0 CA--C 1.532 1.126 0 CA-C-N 118.826 0.739 . . . . 0.0 111.559 171.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.2 tp60 -61.61 -42.26 98.63 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.77 1.228 . . . . 0.0 112.648 173.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -64.45 -51.88 60.83 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.307 1.043 . . . . 0.0 110.42 177.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 55.8 mt -60.85 -37.4 76.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 O-C-N 121.501 -0.749 . . . . 0.0 110.597 179.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.2 tpt -63.88 -46.57 84.33 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.88 1.272 . . . . 0.0 112.892 173.59 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.3 p -78.5 -27.24 14.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 CA-C-N 119.73 1.15 . . . . 0.0 113.683 -176.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 55.0 mmtt -90.48 -15.72 30.27 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 125.074 1.349 . . . . 0.0 113.365 173.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.4 mp0 54.35 60.08 3.79 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 127.034 2.134 . . . . 0.0 113.105 -174.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.9 tp -95.62 6.18 49.6 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.08 0.952 . . . . 0.0 113.301 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 47.4 p90 -95.68 159.8 14.81 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 126.109 1.763 . . . . 0.0 111.022 173.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -86.07 129.24 34.9 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.518 -0.739 . . . . 0.0 111.836 172.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.35 -24.26 66.48 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 120.799 -1.188 . . . . 0.0 112.752 176.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 49.7 mm-40 -78.68 -30.57 46.23 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.28 -0.887 . . . . 0.0 110.756 -176.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -151.72 80.58 1.28 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 128.036 2.534 . . . . 0.0 110.159 -169.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 27.2 mp0 -60.76 -15.54 30.67 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 114.292 1.219 . . . . 0.0 114.292 -174.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 21.6 p80 -64.31 -22.51 66.98 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 118.402 -0.809 . . . . 0.0 113.113 171.548 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.8 ttm -96.88 137.27 36.23 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 119.838 1.199 . . . . 0.0 112.783 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 52.7 t -132.06 138.32 52.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 126.419 1.888 . . . . 0.0 110.18 -179.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -104.16 51.02 0.78 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.934 1.293 . . . . 0.0 113.889 -171.007 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 90.4 m -69.39 -1.61 8.82 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 115.321 1.6 . . . . 0.0 115.321 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.36 -25.19 60.1 Favored Glycine 0 CA--C 1.539 1.578 0 CA-C-N 120.462 1.483 . . . . 0.0 113.686 169.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -91.57 9.96 75.84 Favored Glycine 0 CA--C 1.54 1.653 0 C-N-CA 125.506 1.526 . . . . 0.0 115.064 170.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -119.6 174.83 6.17 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.539 1.536 . . . . 0.0 112.689 -173.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -49.84 -40.17 41.32 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.004 1.722 . . . . 0.0 111.933 176.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 63.1 mt -62.56 -38.12 88.83 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 120.746 0.307 . . . . 0.0 111.155 178.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -79.12 -29.09 52.16 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 125.381 1.467 . . . . 0.0 113.593 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -67.47 -42.23 83.33 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 120.491 2.145 . . . . 0.0 109.606 169.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 24.1 tp -60.66 -48.46 81.69 Favored 'General case' 0 CA--C 1.552 1.023 0 CA-C-N 114.974 -1.012 . . . . 0.0 112.76 177.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 8.1 mt -94.17 -7.39 42.42 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 116.044 1.868 . . . . 0.0 116.044 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.81 -16.33 11.93 Favored Glycine 0 CA--C 1.543 1.836 0 O-C-N 120.701 -1.249 . . . . 0.0 113.797 -169.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.23 155.35 26.88 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 129.024 2.93 . . . . 0.0 109.322 173.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -164.03 25.57 0.07 Allowed 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 119.229 0.922 . . . . 0.0 112.215 169.294 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 17.2 m -84.97 132.01 34.41 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 120.999 -1.063 . . . . 0.0 108.681 175.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 6.3 p90 -161.26 178.57 9.11 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 -167.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 96.7 p -122.88 137.67 54.87 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 114.423 -1.262 . . . . 0.0 113.314 173.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.605 HG21 ' CD5' ' A' ' 200' ' ' 44Z . 15.3 m -73.74 -17.05 17.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 -173.399 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.7 pttt -82.53 -6.31 59.25 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.039 1.736 . . . . 0.0 115.046 -177.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -118.73 83.33 22.1 Favored Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 126.119 1.768 . . . . 0.0 110.585 -173.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.28 -30.69 54.1 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 124.083 3.189 . . . . 0.0 115.315 -169.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 66.9 m -61.72 -53.96 55.95 Favored Pre-proline 0 N--CA 1.475 0.817 0 CA-C-N 119.698 1.136 . . . . 0.0 113.995 -176.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -69.37 -28.38 27.18 Favored 'Trans proline' 0 C--N 1.354 0.818 0 C-N-CA 121.869 1.713 . . . . 0.0 112.764 175.109 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 18.7 tp -66.77 -44.51 81.19 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.884 1.274 . . . . 0.0 111.914 179.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -55.48 -39.09 69.98 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.8 1.24 . . . . 0.0 112.947 176.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -59.7 -47.18 86.67 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.717 0.807 . . . . 0.0 112.396 177.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 16.7 mtm -69.21 -41.85 76.54 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 178.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 65.9 mt -55.34 -54.96 37.06 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.441 1.096 . . . . 0.0 110.588 175.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 72.7 ttt180 -52.44 -31.97 37.17 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.247 1.419 . . . . 0.0 113.223 178.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -78.78 -29.57 45.1 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.272 1.429 . . . . 0.0 113.757 176.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 31.3 m-20 -109.74 -19.16 13.26 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -171.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 47.7 tp -117.37 103.26 9.96 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.218 1.807 . . . . 0.0 106.436 168.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 12.2 p -60.3 116.22 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 CA-C-O 121.423 0.63 . . . . 0.0 111.88 -172.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 6.0 t -161.97 168.64 22.5 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.215 1.406 . . . . 0.0 111.426 -179.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.608 ' H ' HD13 ' A' ' 109' ' ' LEU . 0.0 OUTLIER -93.0 177.59 6.02 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.635 1.574 . . . . 0.0 114.109 175.721 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -135.58 157.28 47.28 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.43 1.892 . . . . 0.0 112.293 -172.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 73.1 p . . . . . 0 N--CA 1.485 1.284 0 C-N-CA 127.04 2.136 . . . . 0.0 114.417 176.609 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 200' ' ' 44Z . . . . . 0.605 ' CD5' HG21 ' A' ' 92' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 . . . . . 0 CA--C 1.545 0.768 0 CA-C-O 121.992 0.901 . . . . 0.0 112.924 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.4 pp -86.09 -3.04 8.36 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 C-N-CA 127.143 2.177 . . . . 0.0 115.803 -170.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 57.7 t30 55.2 8.11 0.24 Allowed 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 127.813 2.445 . . . . 0.0 116.528 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.64 176.37 8.22 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.741 2.016 . . . . 0.0 111.617 178.235 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.4 m -104.19 172.08 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.175 0 C-N-CA 126.207 1.803 . . . . 0.0 112.684 -177.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.1 ttp-105 -87.59 138.53 31.69 Favored Pre-proline 0 N--CA 1.481 1.094 0 C-N-CA 125.175 1.39 . . . . 0.0 111.814 178.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -73.89 177.75 7.73 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 123.959 3.106 . . . . 0.0 113.71 175.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 32.1 ttmt -69.86 155.21 40.9 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.456 1.102 . . . . 0.0 111.296 179.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 68.4 mt -56.25 -45.71 99.88 Favored Pre-proline 0 CA--C 1.544 0.726 0 N-CA-C 116.346 1.98 . . . . 0.0 116.346 -168.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -64.19 -29.46 64.62 Favored 'Trans proline' 0 C--N 1.351 0.693 0 CA-C-N 122.152 1.804 . . . . 0.0 113.262 175.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.3 tt -71.27 -42.53 68.64 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.068 0.849 . . . . 0.0 110.14 176.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 11.5 tp -58.57 -37.15 75.14 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.514 -0.741 . . . . 0.0 111.408 170.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.7 -37.09 85.5 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.146 0.979 . . . . 0.0 113.432 175.262 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 87.8 mt -62.57 -44.53 99.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 CA-C-N 119.043 0.838 . . . . 0.0 110.973 170.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 71.2 mt -62.39 -37.54 86.15 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.529 0.732 . . . . 0.0 111.857 175.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -63.43 -45.28 91.66 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 121.195 -0.941 . . . . 0.0 112.368 169.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.62 -27.06 68.97 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.017 0.927 . . . . 0.0 113.085 177.368 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.463 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -71.49 -7.29 46.57 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.352 1.061 . . . . 0.0 113.447 173.03 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 93.18 8.6 61.33 Favored Glycine 0 CA--C 1.537 1.447 0 C-N-CA 125.537 1.541 . . . . 0.0 114.952 -178.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -97.62 173.94 6.89 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.891 1.276 . . . . 0.0 113.062 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 15.5 tp60 -129.51 149.19 51.39 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 126.511 1.924 . . . . 0.0 108.92 169.407 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.404 ' HA3' ' CZ ' ' A' ' 47' ' ' PHE . . . -158.68 148.92 18.73 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 116.421 1.328 . . . . 0.0 116.421 -174.053 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -133.41 -14.77 2.54 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.973 1.309 . . . . 0.0 113.829 174.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 6.0 mtm -175.41 137.18 0.37 Allowed 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 129.231 3.012 . . . . 0.0 109.367 -178.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.404 ' CZ ' ' HA3' ' A' ' 44' ' ' GLY . 0.0 OUTLIER -158.54 170.21 22.7 Favored 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 114.317 1.228 . . . . 0.0 114.317 174.062 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 70.5 p -90.44 171.62 9.3 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 126.295 1.838 . . . . 0.0 112.131 173.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.8 t -51.56 -44.08 33.19 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 123.634 0.774 . . . . 0.0 110.761 169.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -67.69 -42.86 81.4 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 125.155 1.382 . . . . 0.0 112.89 -179.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -72.52 -32.68 66.32 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 118.433 0.56 . . . . 0.0 112.469 179.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 43.7 t -63.87 -49.28 82.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 123.459 0.703 . . . . 0.0 109.703 169.155 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -65.22 -34.0 77.33 Favored 'General case' 0 N--CA 1.458 -0.072 0 C-N-CA 126.871 2.069 . . . . 0.0 114.301 -176.3 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -51.56 -52.9 43.38 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.543 0.737 . . . . 0.0 111.257 172.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -74.78 -32.83 62.15 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.896 1.443 . . . . 0.0 114.896 172.065 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.67 -41.41 75.54 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 120.674 1.579 . . . . 0.0 113.053 -178.507 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.27 -39.75 98.21 Favored Glycine 0 CA--C 1.533 1.178 0 CA-C-N 118.678 0.672 . . . . 0.0 111.817 173.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.5 tp60 -62.8 -45.33 93.16 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.786 1.234 . . . . 0.0 112.045 172.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.463 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 60.2 t80 -60.76 -49.71 76.41 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.896 0.879 . . . . 0.0 110.426 177.176 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 53.3 mt -62.21 -34.98 66.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 C-N-CA 124.019 0.928 . . . . 0.0 111.236 177.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.76 -38.61 91.58 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 119.575 1.08 . . . . 0.0 112.358 172.102 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 96.5 t -78.28 -34.76 18.88 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 C-N-CA 124.334 1.053 . . . . 0.0 112.998 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 19.0 mmtp -90.16 -14.94 32.51 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.961 1.304 . . . . 0.0 113.328 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.2 mp0 47.34 62.2 2.53 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 127.269 2.228 . . . . 0.0 113.876 -172.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 31.6 mt -82.66 -13.11 57.03 Favored 'General case' 0 N--CA 1.478 0.974 0 O-C-N 121.306 -0.871 . . . . 0.0 112.548 175.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 44.5 p90 -78.69 152.47 31.59 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.045 0.938 . . . . 0.0 111.744 176.12 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -83.41 127.2 33.49 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 121.834 -0.541 . . . . 0.0 110.619 169.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -65.8 -24.47 66.92 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.1 -1.0 . . . . 0.0 113.515 -176.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -85.5 -30.08 23.73 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-O 121.385 0.612 . . . . 0.0 111.337 -171.117 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -148.54 87.82 1.6 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 128.587 2.755 . . . . 0.0 110.064 178.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 29.2 mp0 -61.2 -14.24 24.03 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 -172.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 23.9 p80 -61.74 -30.76 70.99 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 118.278 -0.868 . . . . 0.0 112.378 170.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 21.5 tpp -83.07 128.53 34.57 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 119.781 1.173 . . . . 0.0 111.036 177.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 3.3 t -120.91 122.49 67.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 C-N-CA 126.106 1.762 . . . . 0.0 108.857 174.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -107.49 107.09 17.79 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.509 1.524 . . . . 0.0 109.796 178.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 84.2 m -99.8 20.04 14.91 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.253 1.021 . . . . 0.0 113.27 -177.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.69 122.98 31.85 Favored Glycine 0 CA--C 1.534 1.264 0 O-C-N 120.937 -1.102 . . . . 0.0 111.872 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 78.27 0.4 77.52 Favored Glycine 0 CA--C 1.54 1.65 0 C-N-CA 124.488 1.042 . . . . 0.0 115.374 -174.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -80.72 162.77 23.97 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 119.278 1.539 . . . . 0.0 111.657 171.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -46.47 -40.81 12.99 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.623 1.569 . . . . 0.0 111.743 170.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 97.1 mt -60.18 -43.66 95.68 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.088 0.955 . . . . 0.0 111.998 176.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -71.49 -34.15 63.62 Favored Glycine 0 CA--C 1.533 1.19 0 C-N-CA 124.99 1.281 . . . . 0.0 114.061 176.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -66.85 -42.64 85.4 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 120.637 2.219 . . . . 0.0 110.487 174.061 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 27.1 tp -61.51 -52.65 63.59 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 115.085 -0.961 . . . . 0.0 112.456 177.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -101.91 -6.8 23.06 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -169.568 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.86 -29.22 2.41 Favored Glycine 0 CA--C 1.54 1.651 0 O-C-N 120.349 -1.469 . . . . 0.0 112.805 -169.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.84 135.86 7.65 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 127.633 2.373 . . . . 0.0 111.926 179.012 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 11.6 mt-30 -142.38 45.84 1.62 Allowed 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.29 1.036 . . . . 0.0 109.831 168.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 1.6 m -86.33 128.41 34.92 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 121.161 -0.962 . . . . 0.0 109.184 169.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 17.8 p90 -158.02 168.63 26.59 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.496 0.718 . . . . 0.0 112.856 -169.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 34.6 t -118.61 138.04 52.85 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.828 170.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -77.53 -1.43 3.86 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 12.6 pttp -84.29 -7.81 59.22 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.565 1.146 . . . . 0.0 113.702 169.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -122.89 83.25 49.92 Favored Pre-proline 0 CA--C 1.55 0.981 0 C-N-CA 126.487 1.915 . . . . 0.0 110.819 -170.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -67.46 -27.88 39.28 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.88 3.054 . . . . 0.0 115.269 -170.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 59.6 m -61.79 -53.71 57.97 Favored Pre-proline 0 N--CA 1.477 0.902 0 CA-C-N 119.867 1.212 . . . . 0.0 114.192 -177.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -67.21 -29.98 38.35 Favored 'Trans proline' 0 C--N 1.353 0.777 0 C-N-CA 121.93 1.753 . . . . 0.0 112.636 175.225 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 27.9 tp -65.35 -44.14 88.64 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.408 1.083 . . . . 0.0 111.551 177.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 25.7 t80 -60.43 -36.39 78.07 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.865 1.266 . . . . 0.0 112.195 174.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -65.47 -47.17 77.03 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.664 0.785 . . . . 0.0 112.712 175.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 31.1 mtm -57.59 -49.66 75.68 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.024 0.53 . . . . 0.0 111.768 174.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 7.5 mp -63.11 -47.89 80.86 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-O 117.294 -1.336 . . . . 0.0 111.125 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 61.7 mtp180 -52.0 -29.65 21.73 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-N 121.067 1.758 . . . . 0.0 113.757 175.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -85.82 -20.21 29.5 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.594 1.557 . . . . 0.0 114.879 177.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -126.69 -25.64 3.36 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 115.29 1.589 . . . . 0.0 115.29 -174.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 44.7 tp -118.63 95.71 4.97 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 127.619 2.368 . . . . 0.0 107.179 170.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 12.9 p -59.57 125.54 15.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 CA-C-O 121.869 0.842 . . . . 0.0 112.718 -169.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 13.2 t -159.96 166.21 30.53 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 126.436 1.894 . . . . 0.0 110.248 -176.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.567 ' H ' HD13 ' A' ' 109' ' ' LEU . 0.0 OUTLIER -77.07 169.45 18.32 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.416 1.087 . . . . 0.0 113.521 178.89 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -115.04 160.46 19.59 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.032 1.733 . . . . 0.0 113.084 -169.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 27.3 p . . . . . 0 N--CA 1.483 1.223 0 C-N-CA 127.026 2.13 . . . . 0.0 113.995 178.475 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 200' ' ' 44Z . . . . . 0.448 ' CD3' ' CG1' ' A' ' 200' ' ' 44Z . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 . . . . . 0 CA--C 1.544 0.712 0 CA-C-O 121.015 0.435 . . . . 0.0 112.152 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 46.5 mm -78.28 129.43 37.52 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 123.874 0.869 . . . . 0.0 111.981 -175.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 66.8 t30 -134.88 -8.37 2.38 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 126.637 1.975 . . . . 0.0 112.565 169.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 17.8 pm0 -82.81 172.9 12.36 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 128.728 2.811 . . . . 0.0 112.625 177.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 34.8 m -104.14 172.31 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 126.599 1.96 . . . . 0.0 112.103 178.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.4 ptt-85 -94.29 156.98 38.25 Favored Pre-proline 0 N--CA 1.488 1.425 0 C-N-CA 124.65 1.18 . . . . 0.0 112.015 169.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -68.06 176.43 5.41 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 123.839 3.026 . . . . 0.0 112.756 169.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 24.4 ttmt -65.11 148.06 52.35 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.136 0.974 . . . . 0.0 111.2 179.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 81.8 mt -53.4 -50.74 81.15 Favored Pre-proline 0 N--CA 1.477 0.914 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -169.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -64.43 -22.07 65.96 Favored 'Trans proline' 0 CA--C 1.54 0.777 0 C-N-CA 122.262 1.975 . . . . 0.0 114.142 175.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.1 tt -77.9 -37.51 47.81 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 119.825 1.193 . . . . 0.0 110.54 169.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 16.2 tp -58.58 -35.09 71.86 Favored 'General case' 0 N--CA 1.475 0.775 0 O-C-N 120.765 -1.209 . . . . 0.0 112.264 171.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.439 ' HA ' ' HE2' ' A' ' 35' ' ' LYS . 9.0 mmpt? -59.84 -26.62 65.96 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 172.131 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 81.8 mt -73.04 -36.98 52.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 123.977 0.911 . . . . 0.0 110.662 176.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.4 mp -70.51 -34.3 72.17 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.152 -0.967 . . . . 0.0 111.279 172.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 43.6 m170 -63.15 -42.44 99.44 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.796 -0.565 . . . . 0.0 111.532 169.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.79 -28.54 69.94 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.153 0.981 . . . . 0.0 113.166 173.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.453 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -70.54 -6.51 36.87 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 124.153 0.981 . . . . 0.0 113.33 171.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 92.47 16.54 49.14 Favored Glycine 0 CA--C 1.535 1.344 0 C-N-CA 125.309 1.433 . . . . 0.0 115.142 177.394 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -123.76 139.99 53.43 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 118.77 1.285 . . . . 0.0 113.421 -176.316 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -77.04 151.86 35.36 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.164 0.986 . . . . 0.0 110.192 169.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -165.32 146.89 11.64 Favored Glycine 0 CA--C 1.527 0.834 0 N-CA-C 115.221 0.848 . . . . 0.0 115.221 176.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -137.58 -14.03 1.48 Allowed 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 114.687 1.365 . . . . 0.0 114.687 -175.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 5.9 mtm -176.45 126.35 0.19 Allowed 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 128.44 2.696 . . . . 0.0 109.658 -176.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -170.42 152.03 3.89 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 114.507 1.299 . . . . 0.0 114.507 176.572 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 42.9 p -75.41 175.32 8.55 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 126.351 1.861 . . . . 0.0 113.163 176.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 8.9 t -54.54 -50.1 61.29 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 O-C-N 120.614 -1.304 . . . . 0.0 110.401 169.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -56.43 -37.37 70.12 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.287 0.949 . . . . 0.0 112.587 -177.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -79.23 -30.79 43.38 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.687 1.195 . . . . 0.0 113.474 176.013 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 49.6 t -75.28 -46.05 39.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.124 0.97 . . . . 0.0 111.777 176.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.423 ' SD ' ' CD2' ' A' ' 200' ' ' 44Z . 29.4 mmt -62.36 -26.81 68.66 Favored 'General case' 0 N--CA 1.483 1.221 0 CA-C-N 119.907 1.231 . . . . 0.0 113.116 -177.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -51.56 -52.95 43.04 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.18 170.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -74.88 -36.99 62.25 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 170.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -75.18 -41.47 57.94 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 120.831 -1.168 . . . . 0.0 112.898 -171.578 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -64.11 -35.92 92.59 Favored Glycine 0 CA--C 1.531 1.052 0 O-C-N 121.654 -0.654 . . . . 0.0 111.814 171.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 9.1 tp60 -64.48 -44.55 90.65 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.679 1.191 . . . . 0.0 111.912 171.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.453 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 42.6 t80 -60.21 -48.84 80.04 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.637 0.775 . . . . 0.0 110.364 175.225 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 58.1 mt -63.04 -35.27 70.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 124.108 0.963 . . . . 0.0 111.241 177.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.0 tpt -65.57 -35.7 81.62 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.447 1.099 . . . . 0.0 112.516 173.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 64.0 t -78.35 -47.74 23.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 O-C-N 120.848 -1.158 . . . . 0.0 112.29 175.11 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 18.2 mmtp -80.62 -13.43 59.05 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.52 1.128 . . . . 0.0 112.624 -174.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 51.79 63.95 2.04 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 127.901 2.48 . . . . 0.0 113.434 176.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 37.1 mt -86.6 -11.27 51.93 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.726 0.81 . . . . 0.0 112.729 178.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 45.4 p90 -84.73 154.61 22.33 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.208 1.003 . . . . 0.0 111.632 175.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -88.42 129.15 35.5 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 169.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.75 -31.02 57.97 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 113.876 1.065 . . . . 0.0 113.876 179.23 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -93.91 -17.71 22.71 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.721 1.209 . . . . 0.0 112.702 -172.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -140.84 64.01 1.44 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.837 2.455 . . . . 0.0 109.677 -177.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -62.96 -18.06 62.75 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 -171.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 27.7 p80 -61.1 -32.03 71.71 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.624 0.77 . . . . 0.0 112.761 169.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 7.1 ttm -89.26 136.78 32.83 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.516 1.126 . . . . 0.0 112.021 178.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 3.6 t -122.19 126.58 74.52 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 C-N-CA 125.906 1.682 . . . . 0.0 108.3 172.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -106.22 101.43 10.91 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.396 1.078 . . . . 0.0 109.929 178.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 13.7 m -101.28 9.52 41.66 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.673 0.789 . . . . 0.0 112.976 -179.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.87 -27.92 65.12 Favored Glycine 0 CA--C 1.54 1.646 0 O-C-N 120.912 -1.118 . . . . 0.0 114.169 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -94.13 7.09 72.75 Favored Glycine 0 CA--C 1.541 1.674 0 C-N-CA 125.527 1.537 . . . . 0.0 115.07 171.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -105.97 167.24 9.93 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.109 1.764 . . . . 0.0 112.3 -176.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -46.43 -43.33 16.37 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 126.22 1.808 . . . . 0.0 111.7 169.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 81.0 mt -60.24 -39.86 88.21 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.135 0.574 . . . . 0.0 112.44 176.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -69.65 -37.98 77.55 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 124.573 1.082 . . . . 0.0 113.784 174.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -63.77 -42.73 97.75 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 120.133 1.966 . . . . 0.0 110.897 173.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 29.6 tp -62.06 -49.08 77.42 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 126.096 1.758 . . . . 0.0 112.85 179.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -105.28 -6.85 19.33 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.707 1.203 . . . . 0.0 113.521 -171.105 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 78.66 -30.06 2.0 Favored Glycine 0 CA--C 1.54 1.643 0 O-C-N 120.254 -1.529 . . . . 0.0 113.564 -169.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.94 132.03 9.98 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 127.942 2.497 . . . . 0.0 110.414 176.629 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -144.4 35.03 1.18 Allowed 'General case' 0 N--CA 1.476 0.843 0 CA-C-O 121.901 0.858 . . . . 0.0 110.426 176.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.2 m -99.0 139.37 34.74 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.381 0.673 . . . . 0.0 111.178 179.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 53.9 p90 -163.56 177.24 8.96 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.801 1.24 . . . . 0.0 112.77 -168.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 29.8 t -128.47 141.22 51.46 Favored 'General case' 0 CA--C 1.52 -0.208 0 C-N-CA 124.37 1.068 . . . . 0.0 110.921 168.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.415 HG21 ' CE5' ' A' ' 200' ' ' 44Z . 22.7 m -72.25 -9.95 13.45 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 177.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 43.8 pttt -77.11 -10.86 59.66 Favored 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 169.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 44.0 t0 -123.4 77.45 53.9 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 126.431 1.893 . . . . 0.0 109.615 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -70.0 -25.73 27.19 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 123.406 2.737 . . . . 0.0 114.954 -169.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 49.4 m -61.28 -53.47 62.46 Favored Pre-proline 0 N--CA 1.476 0.834 0 CA-C-N 119.867 1.212 . . . . 0.0 114.119 -177.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -66.05 -32.13 44.62 Favored 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.081 1.854 . . . . 0.0 113.011 176.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 39.1 tp -63.4 -51.49 65.57 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.63 1.172 . . . . 0.0 110.079 175.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 68.4 t80 -54.75 -45.92 74.26 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.437 1.095 . . . . 0.0 112.281 171.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -65.27 -35.81 82.17 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 114.077 1.139 . . . . 0.0 114.077 -175.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 55.1 mtm -68.85 -49.78 55.42 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 120.925 0.393 . . . . 0.0 111.401 169.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.2 mp -61.11 -29.59 69.85 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 124.805 1.242 . . . . 0.0 112.463 -179.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 13.7 ttm-85 -52.12 -28.4 17.68 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.701 1.6 . . . . 0.0 113.173 169.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -88.4 -23.41 23.34 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.496 1.518 . . . . 0.0 114.153 173.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 27.0 m120 -123.9 -22.54 4.85 Favored 'General case' 0 N--CA 1.486 1.364 0 N-CA-C 117.141 2.275 . . . . 0.0 117.141 -169.154 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 60.0 tp -129.23 154.48 46.76 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.641 1.976 . . . . 0.0 111.588 -169.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 11.7 p -61.37 125.94 18.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 O-C-N 121.632 -0.668 . . . . 0.0 111.048 173.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 3.4 t -159.7 -174.49 4.64 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.625 1.17 . . . . 0.0 111.71 -177.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -78.17 17.78 0.59 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.698 1.999 . . . . 0.0 115.292 -169.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -154.04 146.72 24.21 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.66 1.584 . . . . 0.0 111.842 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 66.8 p . . . . . 0 N--CA 1.484 1.251 0 C-N-CA 127.342 2.257 . . . . 0.0 114.759 174.348 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 200' ' ' 44Z . . . . . 0.423 ' CD2' ' SD ' ' A' ' 53' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 53.3 mm-40 . . . . . 0 CA--C 1.542 0.67 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.3 mt -136.26 151.84 29.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 125.885 1.674 . . . . 0.0 109.581 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -120.12 76.3 1.16 Allowed 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.311 1.444 . . . . 0.0 110.169 174.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 7.8 mp0 -79.5 175.08 10.93 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.584 1.154 . . . . 0.0 113.612 -172.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.8 m -104.13 170.43 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 126.503 1.921 . . . . 0.0 111.62 174.09 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 44.9 ttp180 -104.99 136.74 19.12 Favored Pre-proline 0 N--CA 1.479 0.976 0 C-N-CA 124.711 1.204 . . . . 0.0 110.994 177.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -75.99 177.93 8.1 Favored 'Trans proline' 0 CA--C 1.537 0.629 0 C-N-CA 123.171 2.581 . . . . 0.0 112.331 171.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.5 ttmt -63.0 148.26 48.21 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.686 0.794 . . . . 0.0 110.219 176.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 85.3 mt -58.17 -43.17 98.09 Favored Pre-proline 0 N--CA 1.475 0.811 0 N-CA-C 114.74 1.385 . . . . 0.0 114.74 -169.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -64.45 -27.24 62.48 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 CA-C-N 122.581 1.958 . . . . 0.0 114.04 174.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.9 tt -70.11 -38.84 75.7 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 120.914 -1.116 . . . . 0.0 110.014 171.079 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.9 tp -60.12 -38.63 83.6 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 121.264 -0.898 . . . . 0.0 111.808 170.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.423 ' HA ' ' HE2' ' A' ' 35' ' ' LYS . 8.8 mmpt? -64.05 -40.85 97.19 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.769 0.828 . . . . 0.0 112.429 173.034 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 76.0 mt -62.93 -40.31 88.44 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 124.658 1.183 . . . . 0.0 111.624 175.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 77.6 mt -64.0 -40.71 96.98 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 121.053 -1.03 . . . . 0.0 112.846 170.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 51.4 m170 -60.43 -43.99 96.23 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 119.241 0.928 . . . . 0.0 111.688 171.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -65.64 -25.57 67.42 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.504 1.121 . . . . 0.0 113.059 179.182 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.426 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -73.74 -4.42 34.4 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 123.988 0.915 . . . . 0.0 113.442 172.109 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.35 9.17 65.4 Favored Glycine 0 CA--C 1.536 1.367 0 C-N-CA 125.298 1.428 . . . . 0.0 114.8 -179.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -98.51 144.93 27.3 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.662 1.185 . . . . 0.0 112.277 179.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.6 tp60 -73.77 136.46 43.61 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 121.456 -0.778 . . . . 0.0 109.626 169.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -110.5 93.06 0.71 Allowed Glycine 0 CA--C 1.522 0.517 0 N-CA-C 114.317 0.487 . . . . 0.0 114.317 -172.334 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -146.85 73.64 1.32 Allowed 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.532 1.533 . . . . 0.0 109.939 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 25.7 mtm 65.35 134.31 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 129.77 3.228 . . . . 0.0 117.082 171.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -163.45 163.35 24.89 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 114.052 1.131 . . . . 0.0 114.052 -170.141 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 31.9 p -78.01 170.99 15.68 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.077 1.351 . . . . 0.0 112.458 172.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -53.32 -41.74 45.03 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 O-C-N 121.118 -0.989 . . . . 0.0 111.35 169.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -68.22 -42.95 79.02 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.517 1.127 . . . . 0.0 112.643 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -67.03 -39.28 86.98 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.332 0.653 . . . . 0.0 112.141 177.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 54.5 t -62.44 -46.43 96.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 123.873 0.869 . . . . 0.0 110.838 170.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.78 -37.52 86.55 Favored 'General case' 0 N--CA 1.458 -0.071 0 C-N-CA 126.243 1.817 . . . . 0.0 114.027 -175.178 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 84.4 t60 -51.62 -51.12 58.17 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 122.677 0.391 . . . . 0.0 111.498 172.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 54.5 m-85 -74.74 -33.2 62.31 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 114.522 1.304 . . . . 0.0 114.522 174.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.68 -42.79 77.33 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 120.703 1.592 . . . . 0.0 112.905 178.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.04 -44.0 98.38 Favored Glycine 0 CA--C 1.53 1.008 0 N-CA-C 111.548 -0.621 . . . . 0.0 111.548 173.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.7 tp60 -60.27 -42.05 94.59 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.449 1.099 . . . . 0.0 112.429 172.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.426 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 68.3 t80 -64.6 -51.66 61.57 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.837 1.255 . . . . 0.0 110.718 178.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 59.8 mt -62.09 -37.47 78.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 C-N-CA 123.855 0.862 . . . . 0.0 110.398 178.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -63.58 -47.3 82.07 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.492 1.117 . . . . 0.0 112.748 174.247 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.0 p -78.43 -28.06 14.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 124.111 0.965 . . . . 0.0 113.5 -174.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 20.9 mmtp -95.48 -12.03 26.53 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.317 1.447 . . . . 0.0 113.826 174.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 16.5 mp0 55.37 61.41 2.89 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.612 1.965 . . . . 0.0 113.632 -177.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 40.2 mt -92.77 4.53 53.63 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.543 0.737 . . . . 0.0 112.907 173.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 51.7 p90 -89.46 153.67 20.64 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.362 1.465 . . . . 0.0 110.531 169.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -79.69 122.29 26.37 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.732 -0.605 . . . . 0.0 109.381 169.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 4.6 pm0 -61.86 -34.83 76.7 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.732 1.012 . . . . 0.0 113.732 -174.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -82.86 -25.21 32.79 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.614 0.766 . . . . 0.0 111.799 -175.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -139.98 74.51 1.47 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.998 2.119 . . . . 0.0 110.682 -179.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -58.23 -14.93 8.19 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 114.697 1.369 . . . . 0.0 114.697 -178.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 21.7 p80 -67.8 -1.91 6.25 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 117.995 -1.002 . . . . 0.0 113.668 169.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 14.8 ttm -117.74 140.01 50.27 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.933 1.693 . . . . 0.0 113.284 169.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 54.8 t -115.71 142.42 28.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 127.572 2.349 . . . . 0.0 109.608 169.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -123.04 52.83 1.33 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.287 1.435 . . . . 0.0 112.135 -173.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 67.9 m -75.16 2.41 10.9 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 120.748 -1.22 . . . . 0.0 114.277 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.36 -23.64 54.06 Favored Glycine 0 CA--C 1.539 1.586 0 CA-C-N 120.155 1.343 . . . . 0.0 114.655 173.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -88.34 2.46 85.05 Favored Glycine 0 CA--C 1.54 1.651 0 C-N-CA 124.964 1.269 . . . . 0.0 115.34 171.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -111.56 -174.42 2.46 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 119.158 1.479 . . . . 0.0 113.217 -172.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -63.92 -33.9 76.74 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 120.873 -1.142 . . . . 0.0 111.759 176.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.5 tp -65.22 -38.61 90.96 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-O 121.821 0.819 . . . . 0.0 110.207 173.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -64.02 -40.63 98.37 Favored Glycine 0 CA--C 1.532 1.138 0 C-N-CA 125.074 1.321 . . . . 0.0 113.602 171.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -73.07 -29.42 62.95 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 120.248 2.024 . . . . 0.0 112.009 177.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 23.7 tp -65.57 -50.01 66.73 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.023 1.329 . . . . 0.0 111.65 172.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.45 -5.78 31.74 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 -173.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 77.74 -28.19 1.86 Allowed Glycine 0 CA--C 1.54 1.652 0 C-N-CA 125.502 1.525 . . . . 0.0 113.627 -170.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.3 128.83 9.22 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 127.925 2.49 . . . . 0.0 110.451 175.499 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -140.63 40.57 1.86 Allowed 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.608 1.163 . . . . 0.0 110.072 175.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 10.7 m -103.77 132.22 50.23 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 169.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 40.1 p90 -163.51 169.32 18.94 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.219 1.407 . . . . 0.0 112.384 -167.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 17.2 m -107.64 135.3 49.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 122.396 1.093 . . . . 0.0 110.95 173.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -78.16 -23.4 13.66 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 C-N-CA 125.839 1.656 . . . . 0.0 113.332 -169.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.7 pttt -79.97 -5.28 55.39 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 126.299 1.84 . . . . 0.0 115.333 179.12 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 42.8 t0 -116.21 86.32 17.17 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 126.373 1.869 . . . . 0.0 110.735 -170.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -61.1 -36.94 79.12 Favored 'Trans proline' 0 CA--C 1.537 0.674 0 C-N-CA 124.29 3.327 . . . . 0.0 115.423 -170.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 67.9 m -58.95 -54.91 51.72 Favored Pre-proline 0 N--CA 1.477 0.894 0 CA-C-N 119.848 1.204 . . . . 0.0 114.076 -175.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -70.05 -24.75 27.98 Favored 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 121.956 1.771 . . . . 0.0 112.97 175.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 24.0 tp -67.83 -48.94 64.81 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.323 1.049 . . . . 0.0 110.822 178.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 22.9 m-30 -62.5 -35.71 80.25 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.856 0.862 . . . . 0.0 112.572 177.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -59.88 -42.32 93.52 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.002 0.921 . . . . 0.0 112.735 178.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.424 ' HB2' ' HE2' ' A' ' 101' ' ' MET . 35.4 mtm -72.01 -48.67 43.01 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.795 0.838 . . . . 0.0 112.521 172.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -59.13 -39.59 82.83 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-O 117.793 -1.099 . . . . 0.0 110.974 -175.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 76.6 mtt180 -54.71 -25.48 27.73 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 171.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -87.67 -24.1 24.01 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.437 1.495 . . . . 0.0 114.081 173.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -111.05 -28.38 8.34 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 114.112 1.152 . . . . 0.0 114.112 -170.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 3.2 tt -133.93 117.55 16.87 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 127.587 2.355 . . . . 0.0 108.021 -177.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 84.2 t -61.49 119.36 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 O-C-N 121.588 -0.695 . . . . 0.0 111.332 -171.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 5.2 t -158.35 179.73 8.87 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 126.551 1.94 . . . . 0.0 110.346 178.019 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -94.14 170.43 9.53 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.535 1.134 . . . . 0.0 113.723 -170.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -125.2 169.87 11.81 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.741 2.017 . . . . 0.0 113.175 -169.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 12.0 t . . . . . 0 N--CA 1.479 1.021 0 C-N-CA 124.155 0.982 . . . . 0.0 113.458 176.673 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 200' ' ' 44Z . . . . . 0.438 ' CD3' ' CG1' ' A' ' 200' ' ' 44Z . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 . . . . . 0 CA--C 1.543 0.691 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.3 mt -117.46 30.74 2.13 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.975 0 C-N-CA 126.688 1.995 . . . . 0.0 109.822 179.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 69.4 m-20 50.74 34.71 10.48 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 126.636 1.974 . . . . 0.0 113.673 -175.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.1 pm0 -84.56 173.55 10.71 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -171.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 35.7 m -131.37 172.36 16.39 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 127.054 2.141 . . . . 0.0 111.548 -176.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.8 ttp-105 -93.73 137.15 23.31 Favored Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 125.405 1.482 . . . . 0.0 111.438 178.113 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -75.81 177.98 8.01 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 124.36 3.374 . . . . 0.0 113.843 -178.129 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.9 ttmt -61.82 147.08 47.62 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.366 1.066 . . . . 0.0 110.549 175.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.3 mp -54.07 -48.09 95.16 Favored Pre-proline 0 N--CA 1.472 0.67 0 N-CA-C 115.016 1.487 . . . . 0.0 115.016 -168.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -60.56 -31.26 92.1 Favored 'Trans proline' 0 CA--C 1.537 0.642 0 CA-C-N 122.053 1.769 . . . . 0.0 113.796 177.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 7.5 tt -77.59 -34.7 53.49 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 120.941 -1.1 . . . . 0.0 111.381 177.42 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 45.1 tp -61.36 -38.53 87.28 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.697 -0.627 . . . . 0.0 111.005 169.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -66.57 -35.58 80.56 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.83 0.852 . . . . 0.0 113.042 174.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 93.5 mt -60.55 -45.48 97.08 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 CA-C-N 119.41 1.004 . . . . 0.0 111.061 169.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.1 mp -69.22 -30.79 69.03 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 121.047 -1.033 . . . . 0.0 112.864 177.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 30.1 m170 -67.39 -42.88 82.62 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.188 -0.945 . . . . 0.0 111.557 169.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.23 -25.33 68.02 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.18 0.992 . . . . 0.0 113.117 174.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.411 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -69.62 -9.17 53.06 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 171.282 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 78.65 19.99 72.27 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 125.144 1.354 . . . . 0.0 114.254 -177.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -108.23 7.62 27.47 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 116.048 1.87 . . . . 0.0 116.048 -169.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.427 ' HG2' ' H ' ' A' ' 44' ' ' GLY . 7.3 tt0 48.85 -159.43 0.05 Allowed 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 126.069 1.748 . . . . 0.0 111.211 -169.218 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.427 ' H ' ' HG2' ' A' ' 43' ' ' GLN . . . 165.36 134.66 1.7 Allowed Glycine 0 N--CA 1.469 0.84 0 O-C-N 120.49 -1.381 . . . . 0.0 115.369 169.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -138.67 -19.99 1.03 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.794 1.238 . . . . 0.0 114.143 174.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 3.8 mtm -174.5 131.41 0.36 Allowed 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 128.0 2.52 . . . . 0.0 109.899 -178.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -163.56 152.4 14.08 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 114.569 1.322 . . . . 0.0 114.569 173.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 67.4 p -82.26 174.68 10.94 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 128.153 2.581 . . . . 0.0 112.343 174.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -53.06 -50.37 45.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 CA-C-N 119.908 1.231 . . . . 0.0 109.9 169.046 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 59.1 tptt -55.43 -37.87 68.23 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 119.043 0.838 . . . . 0.0 112.675 -176.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -80.4 -38.85 29.48 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.524 1.13 . . . . 0.0 113.265 175.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 41.9 t -68.11 -50.41 58.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 O-C-N 121.303 -0.873 . . . . 0.0 111.357 -179.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.7 mmm -68.66 -23.91 64.47 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 119.344 0.975 . . . . 0.0 112.642 -173.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -58.9 -55.6 33.07 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.657 0.783 . . . . 0.0 111.303 169.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -74.46 -32.08 62.47 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 177.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.83 -38.57 76.59 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 120.881 -1.137 . . . . 0.0 111.12 174.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.85 -42.05 99.75 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 124.194 0.902 . . . . 0.0 112.41 171.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.8 tp60 -60.37 -43.63 96.37 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.226 1.011 . . . . 0.0 112.11 171.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.411 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 61.6 t80 -60.44 -52.49 64.99 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.838 0.855 . . . . 0.0 110.788 174.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 44.0 mt -60.17 -37.04 71.75 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 124.084 0.954 . . . . 0.0 111.071 179.167 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -64.33 -46.6 82.79 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.372 1.069 . . . . 0.0 112.401 174.17 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.5 p -78.51 -28.52 14.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 N-CA-C 113.66 0.985 . . . . 0.0 113.66 -176.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 57.3 mmtt -91.88 -15.83 27.56 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.148 1.379 . . . . 0.0 113.731 175.038 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 14.1 mp0 54.23 73.26 0.4 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.973 2.109 . . . . 0.0 113.227 -172.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.3 tp -94.62 18.56 11.27 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.892 1.277 . . . . 0.0 112.484 178.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 51.2 p90 -127.53 160.3 31.94 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.628 1.971 . . . . 0.0 111.348 -173.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -81.34 124.74 29.62 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 121.567 -0.708 . . . . 0.0 111.176 172.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.02 -20.19 56.55 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 174.074 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -80.7 -36.69 31.9 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.732 0.813 . . . . 0.0 111.433 -176.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -149.55 92.38 1.92 Allowed 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 127.439 2.296 . . . . 0.0 109.441 -176.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 27.5 mp0 -65.59 -12.41 52.88 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 -169.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 24.3 p80 -66.01 -23.26 66.53 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 170.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 1.9 tpt -81.69 118.84 23.15 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.818 1.647 . . . . 0.0 110.498 175.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 18.2 t -104.14 130.64 54.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 125.904 1.682 . . . . 0.0 108.286 171.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 79.5 t80 -132.45 112.6 12.28 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.227 1.011 . . . . 0.0 109.686 -177.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 23.0 p -76.67 -28.98 56.17 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 114.539 1.311 . . . . 0.0 114.539 -169.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 50.87 -123.84 18.28 Favored Glycine 0 CA--C 1.539 1.567 0 CA-C-N 119.161 0.891 . . . . 0.0 112.136 -173.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -87.77 12.46 63.56 Favored Glycine 0 CA--C 1.542 1.733 0 C-N-CA 125.433 1.492 . . . . 0.0 116.214 176.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -63.12 159.38 17.55 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 119.746 1.773 . . . . 0.0 113.31 -179.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.1 mp -49.17 -37.37 22.18 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.799 1.64 . . . . 0.0 113.465 171.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 89.5 mt -59.76 -44.83 93.67 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 118.911 0.778 . . . . 0.0 111.405 175.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -73.14 -36.73 56.1 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 124.248 0.928 . . . . 0.0 113.099 176.079 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.29 -28.36 66.21 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 119.782 1.791 . . . . 0.0 112.191 178.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 42.9 tp -80.07 -54.53 5.69 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 124.289 1.036 . . . . 0.0 112.71 172.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -88.98 -7.03 56.77 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 123.846 0.858 . . . . 0.0 113.267 -172.095 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.41 -28.61 3.01 Favored Glycine 0 CA--C 1.54 1.605 0 C-N-CA 125.568 1.556 . . . . 0.0 113.001 -169.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.92 139.06 6.09 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 127.67 2.388 . . . . 0.0 111.6 -179.335 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -147.19 54.91 1.09 Allowed 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.904 1.282 . . . . 0.0 109.96 168.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 6.8 m -104.79 130.74 52.83 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-O 121.168 0.509 . . . . 0.0 109.793 169.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 54.4 p90 -168.22 177.04 5.65 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.786 1.634 . . . . 0.0 111.458 -168.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 67.2 p -121.55 143.24 49.4 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 174.205 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.484 HG21 ' CE5' ' A' ' 200' ' ' 44Z . 20.5 m -71.28 -15.18 18.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 N-CA-C 113.996 1.11 . . . . 0.0 113.996 -173.19 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.0 pttt -77.59 -8.12 57.37 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 126.335 1.854 . . . . 0.0 114.419 172.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 44.6 t0 -119.6 78.17 21.0 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 126.142 1.777 . . . . 0.0 110.516 -177.199 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -68.56 -27.61 32.68 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 123.756 2.971 . . . . 0.0 115.288 -169.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 63.7 m -59.35 -54.39 56.62 Favored Pre-proline 0 N--CA 1.478 0.933 0 CA-C-N 120.341 1.428 . . . . 0.0 113.753 -177.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -66.46 -28.9 45.61 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 121.797 1.664 . . . . 0.0 112.585 173.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.97 -52.88 63.84 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.793 1.237 . . . . 0.0 110.631 176.006 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -66.48 -29.28 69.36 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.94 0.896 . . . . 0.0 113.379 174.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -61.76 -50.38 72.61 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.699 1.591 . . . . 0.0 112.377 174.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 36.4 mtm -65.53 -43.08 91.1 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.026 0.53 . . . . 0.0 111.595 175.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 42.8 mt -66.04 -42.27 89.8 Favored 'General case' 0 C--O 1.218 -0.578 0 CA-C-O 117.174 -1.393 . . . . 0.0 112.052 -179.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -56.02 -29.03 59.78 Favored 'General case' 0 N--CA 1.484 1.255 0 CA-C-N 121.347 1.885 . . . . 0.0 113.613 173.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -82.71 -17.6 43.85 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.518 1.527 . . . . 0.0 113.424 175.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -120.87 -15.0 8.41 Favored 'General case' 0 CA--C 1.556 1.196 0 N-CA-C 115.292 1.59 . . . . 0.0 115.292 -172.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 29.6 tp -150.38 139.93 21.55 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 130.484 3.514 . . . . 0.0 108.598 -171.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 48.7 t -75.47 109.99 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 O-C-N 120.795 -1.191 . . . . 0.0 109.387 174.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 7.7 t -155.27 170.16 22.52 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.18 1.392 . . . . 0.0 111.841 -177.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.644 ' H ' HD13 ' A' ' 109' ' ' LEU . 0.0 OUTLIER -79.46 177.3 8.96 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.288 1.435 . . . . 0.0 114.124 -178.665 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -126.86 -176.95 3.85 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.696 1.598 . . . . 0.0 113.818 -169.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 6.0 t . . . . . 0 N--CA 1.475 0.815 0 C-N-CA 125.946 1.698 . . . . 0.0 112.747 -170.554 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 200' ' ' 44Z . . . . . 0.484 ' CE5' HG21 ' A' ' 92' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 . . . . . 0 CA--C 1.539 0.547 0 CA-C-O 121.896 0.855 . . . . 0.0 112.25 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.415 HG12 ' H ' ' A' ' 24' ' ' ILE . 23.2 pt -87.45 -16.25 9.22 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.11 0 N-CA-C 116.989 2.218 . . . . 0.0 116.989 -169.41 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 54.6 t30 53.18 34.49 17.62 Favored 'General case' 0 CA--C 1.557 1.214 0 C-N-CA 126.185 1.794 . . . . 0.0 113.858 -174.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 27.9 mm100 -94.77 167.03 11.69 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.507 1.923 . . . . 0.0 112.218 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 35.5 m -104.17 159.89 4.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 125.323 1.449 . . . . 0.0 113.257 -169.469 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 84.1 mtm-85 -91.75 138.63 24.92 Favored Pre-proline 0 N--CA 1.479 0.992 0 C-N-CA 124.432 1.093 . . . . 0.0 111.167 176.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -80.92 171.88 13.73 Favored 'Trans proline' 0 CA--C 1.538 0.679 0 C-N-CA 123.986 3.124 . . . . 0.0 113.038 178.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.03 149.43 15.51 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.664 0.786 . . . . 0.0 112.475 173.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 92.5 mt -59.85 -50.03 88.6 Favored Pre-proline 0 N--CA 1.476 0.875 0 N-CA-C 114.099 1.148 . . . . 0.0 114.099 -175.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -67.33 -21.34 47.65 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 121.897 1.731 . . . . 0.0 113.118 174.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.4 tt -69.66 -46.03 67.04 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 118.944 0.793 . . . . 0.0 109.826 170.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.2 tp -60.31 -31.76 70.58 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 120.865 -1.147 . . . . 0.0 112.955 176.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.62 -28.85 68.84 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 121.493 -0.754 . . . . 0.0 112.678 171.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 45.0 mt -71.03 -43.89 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 CA-C-N 119.073 0.851 . . . . 0.0 110.573 173.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.88 -38.94 87.4 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.485 0.714 . . . . 0.0 110.733 175.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 53.3 m170 -66.46 -43.83 84.44 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.426 0.69 . . . . 0.0 112.457 172.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.43 -27.99 69.67 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.945 0.898 . . . . 0.0 113.376 176.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.426 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -72.74 -5.22 36.29 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 124.222 1.009 . . . . 0.0 113.475 172.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.54 9.04 65.18 Favored Glycine 0 CA--C 1.537 1.456 0 C-N-CA 125.422 1.487 . . . . 0.0 115.102 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -97.96 165.67 11.81 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.752 1.221 . . . . 0.0 112.952 179.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 21.7 tm0? -118.03 145.22 44.94 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.65 1.58 . . . . 0.0 109.335 169.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -171.77 158.46 29.34 Favored Glycine 0 N--CA 1.467 0.724 0 N-CA-C 116.287 1.275 . . . . 0.0 116.287 -169.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -140.44 -63.69 0.48 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.987 1.715 . . . . 0.0 109.643 169.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 3.3 mpp? -101.63 141.7 34.1 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 127.14 2.176 . . . . 0.0 112.183 179.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 25.0 m-85 -154.41 159.78 41.28 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.369 1.067 . . . . 0.0 113.678 -175.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 71.3 p -95.21 175.02 6.77 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.353 1.461 . . . . 0.0 108.052 166.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -59.08 -40.18 80.24 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 O-C-N 120.011 -1.681 . . . . 0.0 109.981 169.148 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -59.8 -43.99 94.18 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.768 1.227 . . . . 0.0 112.756 178.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -72.67 -36.74 67.99 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 178.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 75.3 t -65.73 -51.95 56.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 CA-C-N 119.388 0.995 . . . . 0.0 110.669 171.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.4 ppp? -68.88 -26.06 64.93 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -169.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 82.8 t60 -60.18 -53.49 57.09 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 119.101 0.864 . . . . 0.0 111.27 172.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 57.3 m-85 -74.4 -30.38 61.92 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 178.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -68.64 -39.76 80.57 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.326 0.966 . . . . 0.0 112.735 172.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.52 -43.58 97.9 Favored Glycine 0 CA--C 1.532 1.132 0 CA-C-N 118.761 0.71 . . . . 0.0 111.722 172.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 36.1 tp60 -58.67 -45.35 89.61 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.104 0.961 . . . . 0.0 112.156 170.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.426 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 51.7 t80 -60.62 -51.59 68.75 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.708 0.803 . . . . 0.0 110.433 177.784 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 48.7 mt -59.19 -38.87 76.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 124.368 1.067 . . . . 0.0 111.039 178.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.0 tpt -64.57 -45.3 87.62 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.387 1.075 . . . . 0.0 112.726 175.05 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.1 p -78.67 -29.54 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-N 119.703 1.138 . . . . 0.0 113.716 -177.024 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 58.0 mmtt -90.74 -15.91 29.38 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.806 1.242 . . . . 0.0 113.36 175.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 14.1 mp0 50.89 73.73 0.27 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 127.182 2.193 . . . . 0.0 112.856 -172.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 11.8 tp -87.44 -4.45 59.01 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.855 0.862 . . . . 0.0 112.187 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 51.3 p90 -99.18 160.0 14.58 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.53 1.932 . . . . 0.0 111.784 177.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -91.99 134.28 34.95 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 169.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -59.6 -32.21 70.18 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -174.471 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -86.62 -20.49 27.78 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 123.795 0.838 . . . . 0.0 112.578 -169.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -140.37 63.28 1.47 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 127.985 2.514 . . . . 0.0 110.257 -178.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -60.22 -19.77 55.89 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.966 0.906 . . . . 0.0 113.254 -179.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 31.8 p80 -63.09 -7.32 5.35 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.43 1.092 . . . . 0.0 113.889 170.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 39.4 mtp -121.0 149.25 42.95 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.35 1.46 . . . . 0.0 112.926 169.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.9 p -124.1 144.37 34.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 126.075 1.75 . . . . 0.0 109.62 173.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -128.73 110.13 11.92 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.792 1.237 . . . . 0.0 110.586 -170.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 19.8 p -78.61 17.09 0.73 Allowed 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 116.723 2.12 . . . . 0.0 116.723 -168.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -53.57 113.14 2.83 Favored Glycine 0 CA--C 1.537 1.438 0 CA-C-N 119.577 1.08 . . . . 0.0 113.605 -172.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 73.6 9.34 78.28 Favored Glycine 0 CA--C 1.541 1.665 0 C-N-CA 124.979 1.276 . . . . 0.0 115.791 -177.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -86.88 158.67 19.28 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 119.355 1.577 . . . . 0.0 113.531 -175.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 27.9 mt -54.31 -37.22 64.59 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.926 1.29 . . . . 0.0 113.126 169.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.61 -42.34 96.63 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.373 -0.829 . . . . 0.0 111.347 174.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -70.49 -34.01 67.89 Favored Glycine 0 CA--C 1.532 1.109 0 CA-C-O 118.609 -1.106 . . . . 0.0 112.986 175.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -71.62 -29.24 64.45 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 120.218 2.009 . . . . 0.0 111.79 175.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 27.7 tp -71.32 -53.09 15.4 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 124.777 1.231 . . . . 0.0 112.419 174.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -102.49 -9.74 19.97 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.085 1.143 . . . . 0.0 114.085 -169.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.03 -32.89 1.97 Allowed Glycine 0 CA--C 1.54 1.625 0 C-N-CA 124.896 1.236 . . . . 0.0 112.57 -169.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.45 123.19 8.62 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 126.777 2.031 . . . . 0.0 112.553 174.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 -136.86 33.8 2.65 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.595 1.558 . . . . 0.0 111.172 177.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 11.4 m -94.14 132.37 38.74 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 169.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 49.6 p90 -162.35 172.33 15.8 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.335 1.054 . . . . 0.0 112.961 -169.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 81.6 p -116.19 136.42 53.03 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 122.452 1.12 . . . . 0.0 113.586 175.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -78.05 -17.69 13.86 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.442 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 -174.668 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.5 pttt -72.8 -8.47 55.63 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.666 1.586 . . . . 0.0 114.637 175.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -120.57 83.36 34.58 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 126.386 1.875 . . . . 0.0 110.147 -177.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -68.12 -25.2 37.74 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.862 3.041 . . . . 0.0 115.224 -169.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 62.5 m -63.52 -54.89 39.55 Favored Pre-proline 0 N--CA 1.476 0.875 0 CA-C-N 119.813 1.188 . . . . 0.0 113.87 -178.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -65.5 -30.38 52.37 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 121.827 1.685 . . . . 0.0 112.553 175.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 22.4 tp -62.61 -47.95 81.54 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.983 0.913 . . . . 0.0 111.11 174.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -59.99 -37.98 81.27 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 121.489 -0.757 . . . . 0.0 112.179 173.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -64.28 -47.26 80.22 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.043 0.937 . . . . 0.0 112.939 176.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.453 ' HB2' ' HE2' ' A' ' 101' ' ' MET . 3.9 mtp -56.9 -44.46 82.38 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.335 1.054 . . . . 0.0 112.111 172.293 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.1 mp -62.53 -47.17 85.06 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.392 1.077 . . . . 0.0 110.567 176.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 14.8 mtt180 -56.98 -21.64 31.96 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.68 1.192 . . . . 0.0 114.142 171.011 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -98.57 -5.17 32.54 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 126.396 1.878 . . . . 0.0 115.01 175.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 18.9 p30 -115.88 -27.6 6.95 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 120.349 1.432 . . . . 0.0 114.479 175.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 39.8 tp -91.27 99.32 12.32 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 126.565 1.946 . . . . 0.0 111.905 175.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . 0.324 0.4 OUTLIER 58.47 1.94 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 N-CA-C 120.127 3.38 . . . . 0.0 120.127 169.726 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 3.0 t -165.5 -179.83 5.69 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 124.416 1.086 . . . . 0.0 112.921 -177.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -118.43 71.45 0.84 Allowed 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 127.185 2.194 . . . . 0.0 111.245 173.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . 56.23 -174.49 0.06 Allowed 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 126.339 1.856 . . . . 0.0 115.088 -178.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 11.8 t . . . . . 0 N--CA 1.48 1.045 0 C-N-CA 124.216 1.006 . . . . 0.0 113.293 -179.738 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 200' ' ' 44Z . . . . . 0.476 ' CD3' ' CD1' ' A' ' 200' ' ' 44Z . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 26.2 mp0 . . . . . 0 CA--C 1.542 0.668 0 CA-C-O 121.174 0.512 . . . . 0.0 112.322 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 15.0 mt -132.1 150.78 34.01 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 125.884 1.674 . . . . 0.0 109.479 -178.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 48.4 p-10 -100.22 32.83 2.84 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 126.304 1.841 . . . . 0.0 113.617 178.027 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 5.1 pm0 -80.18 169.51 17.7 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.16 1.384 . . . . 0.0 113.453 -176.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 33.5 m -127.77 172.24 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 126.124 1.77 . . . . 0.0 111.706 -177.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.7 ttp-105 -87.11 133.04 39.83 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 124.693 1.197 . . . . 0.0 111.721 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -73.19 175.8 10.04 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 123.586 2.857 . . . . 0.0 112.228 173.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.5 tpmt? -61.52 147.31 45.82 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.472 0.709 . . . . 0.0 110.605 177.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -59.32 -40.63 82.05 Favored Pre-proline 0 N--CA 1.473 0.714 0 CA-C-O 117.32 -1.324 . . . . 0.0 114.239 -170.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -61.06 -33.85 91.06 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 121.994 1.796 . . . . 0.0 113.696 173.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.2 tt -70.12 -40.75 74.7 Favored 'General case' 0 CA--C 1.546 0.804 0 O-C-N 121.469 -0.769 . . . . 0.0 109.666 175.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.8 tt -63.91 -35.4 80.54 Favored 'General case' 0 N--CA 1.475 0.825 0 O-C-N 120.858 -1.151 . . . . 0.0 112.791 172.367 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.66 -38.91 92.15 Favored 'General case' 0 N--CA 1.48 1.026 0 O-C-N 121.216 -0.928 . . . . 0.0 112.223 170.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 91.8 mt -67.06 -38.33 81.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 123.676 0.79 . . . . 0.0 111.636 174.065 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 77.0 mt -61.99 -40.73 96.63 Favored 'General case' 0 CA--C 1.544 0.75 0 O-C-N 121.107 -0.996 . . . . 0.0 112.142 170.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 34.8 m170 -62.22 -42.95 99.77 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 119.332 0.969 . . . . 0.0 112.293 170.03 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.25 -25.43 68.05 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 177.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.56 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -72.91 -7.37 50.66 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 172.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 89.4 6.35 71.02 Favored Glycine 0 CA--C 1.537 1.449 0 C-N-CA 125.228 1.394 . . . . 0.0 114.584 -175.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -87.71 177.86 6.91 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.706 1.202 . . . . 0.0 112.263 175.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.96 149.3 43.12 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.257 1.423 . . . . 0.0 109.942 172.339 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 176.12 161.68 25.68 Favored Glycine 0 CA--C 1.527 0.802 0 N-CA-C 116.791 1.476 . . . . 0.0 116.791 170.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -125.65 8.52 7.62 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 126.018 1.727 . . . . 0.0 112.444 171.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.1 mtm -170.95 135.36 1.03 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 128.888 2.875 . . . . 0.0 109.055 -177.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -149.27 144.39 26.47 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -176.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 46.6 p -86.59 169.47 12.73 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.471 1.108 . . . . 0.0 111.304 168.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.1 t -56.16 -46.18 81.06 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 O-C-N 120.661 -1.274 . . . . 0.0 109.943 169.338 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -56.59 -35.93 68.8 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.721 0.808 . . . . 0.0 113.074 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -77.32 -46.16 23.82 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 173.195 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 74.8 t -63.93 -49.45 81.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 O-C-N 121.451 -0.781 . . . . 0.0 111.756 -177.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -71.24 -27.28 63.36 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 119.89 1.223 . . . . 0.0 112.287 -172.261 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -58.81 -54.45 46.95 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.345 0.658 . . . . 0.0 111.118 170.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -74.35 -32.29 62.73 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 178.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -68.05 -41.98 81.19 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 119.996 1.271 . . . . 0.0 111.823 173.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -61.36 -47.28 91.67 Favored Glycine 0 CA--C 1.527 0.81 0 CA-C-N 119.018 0.826 . . . . 0.0 111.624 173.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.3 tp60 -55.97 -47.9 76.8 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.384 1.073 . . . . 0.0 112.094 172.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.56 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 47.9 t80 -60.36 -48.79 80.25 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.121 0.968 . . . . 0.0 110.894 177.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 58.3 mt -60.85 -36.93 74.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 125.21 1.404 . . . . 0.0 111.148 178.244 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 35.3 mmt -66.34 -38.52 87.83 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.551 1.068 . . . . 0.0 113.051 171.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 82.2 t -78.31 -32.21 16.66 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 CA-C-N 119.217 0.917 . . . . 0.0 112.906 -178.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 47.2 mmtt -91.47 -15.54 28.67 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.159 1.383 . . . . 0.0 113.0 177.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.5 mp0 52.3 63.98 2.03 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.344 1.857 . . . . 0.0 113.038 -173.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 89.5 mt -92.46 18.95 7.74 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 124.432 1.093 . . . . 0.0 112.146 176.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 36.0 p90 -124.33 158.49 32.49 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 126.517 1.927 . . . . 0.0 111.005 -177.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -87.08 128.43 35.1 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.791 -0.568 . . . . 0.0 111.175 172.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -61.51 -20.72 63.52 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 172.059 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -81.78 -36.56 28.32 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.055 0.942 . . . . 0.0 111.291 -177.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -148.24 85.02 1.51 Allowed 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 127.321 2.248 . . . . 0.0 109.867 -173.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 28.3 mp0 -62.5 -15.64 51.28 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -172.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 27.3 p80 -65.88 -23.74 66.71 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 172.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.2 tpt -81.77 128.66 34.23 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.536 1.534 . . . . 0.0 110.758 175.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 3.9 t -126.16 112.39 29.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 C-N-CA 125.48 1.512 . . . . 0.0 109.4 179.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 35.9 t80 -95.46 52.25 1.37 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.875 1.27 . . . . 0.0 112.09 -170.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 55.6 m -69.69 -5.39 24.65 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 179.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.63 -25.12 58.04 Favored Glycine 0 CA--C 1.541 1.704 0 CA-C-N 120.116 1.326 . . . . 0.0 113.524 169.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -88.81 2.83 84.66 Favored Glycine 0 CA--C 1.542 1.728 0 C-N-CA 125.392 1.472 . . . . 0.0 115.295 171.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -108.93 172.99 6.52 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.174 1.79 . . . . 0.0 112.552 -177.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.8 tp -46.57 -43.05 16.84 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 126.809 2.044 . . . . 0.0 112.11 169.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 67.4 mt -54.79 -43.14 72.6 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-O 122.113 0.959 . . . . 0.0 112.159 173.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -74.64 -32.24 57.63 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 125.95 1.738 . . . . 0.0 114.412 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -67.25 -42.66 83.57 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 120.109 1.955 . . . . 0.0 110.374 169.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 24.9 tp -59.64 -50.95 71.88 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.413 1.485 . . . . 0.0 111.903 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -96.58 -13.8 22.67 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 -178.591 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.77 -18.24 12.85 Favored Glycine 0 CA--C 1.541 1.688 0 C-N-CA 125.641 1.591 . . . . 0.0 115.825 -178.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.41 17.99 1.52 Allowed 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 115.934 1.827 . . . . 0.0 115.934 -176.697 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.7 tp60 -68.05 40.73 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.045 0 N-CA-C 118.011 2.597 . . . . 0.0 118.011 -167.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 72.4 m -97.71 144.01 27.78 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 120.419 -1.426 . . . . 0.0 109.202 168.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 55.0 p90 -159.5 162.98 35.62 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -169.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 13.8 m -125.43 136.55 53.51 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.394 1.078 . . . . 0.0 110.679 177.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.488 HG21 ' CE5' ' A' ' 200' ' ' 44Z . 20.1 m -77.42 -11.38 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -170.513 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -78.04 -13.88 59.71 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.875 1.27 . . . . 0.0 113.498 178.017 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -120.56 81.22 31.64 Favored Pre-proline 0 CA--C 1.547 0.86 0 C-N-CA 127.916 2.486 . . . . 0.0 108.874 179.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.18 -27.51 16.67 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 123.502 2.801 . . . . 0.0 114.739 -169.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 45.6 m -57.28 -51.06 84.54 Favored Pre-proline 0 N--CA 1.478 0.938 0 CA-C-N 120.342 1.428 . . . . 0.0 114.21 -178.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -67.49 -27.45 39.5 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 121.901 1.734 . . . . 0.0 113.38 175.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 21.8 tp -68.81 -42.45 77.26 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.292 1.037 . . . . 0.0 110.957 174.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -61.55 -33.79 74.45 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 118.126 -0.94 . . . . 0.0 112.675 172.395 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -62.96 -47.07 84.77 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 120.408 1.458 . . . . 0.0 112.377 176.384 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.432 ' HB2' ' HE2' ' A' ' 101' ' ' MET . 5.7 mtm -58.78 -47.43 84.75 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.023 0.929 . . . . 0.0 111.631 172.488 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.8 mp -67.06 -38.75 86.36 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 118.033 -0.984 . . . . 0.0 112.305 -179.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 7.6 mpt_? -56.04 -24.99 42.98 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-N 120.539 1.518 . . . . 0.0 113.345 171.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -93.07 -13.62 28.35 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.057 1.743 . . . . 0.0 114.076 176.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 21.6 t30 -131.89 -20.06 2.54 Favored 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 116.579 2.066 . . . . 0.0 116.579 -173.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 48.3 tp -133.39 124.05 26.45 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 126.498 1.919 . . . . 0.0 114.693 -169.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . 0.321 0.9 OUTLIER 49.63 13.83 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 C-N-CA 129.607 3.163 . . . . 0.0 119.098 168.173 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 4.9 t -166.21 178.13 6.47 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.005 1.722 . . . . 0.0 111.189 176.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -112.3 -20.32 11.89 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 115.441 1.645 . . . . 0.0 115.441 176.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -174.83 162.99 3.3 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 128.175 2.59 . . . . 0.0 112.465 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 68.7 p . . . . . 0 N--CA 1.486 1.366 0 C-N-CA 127.005 2.122 . . . . 0.0 115.124 169.434 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 200' ' ' 44Z . . . . . 0.488 ' CE5' HG21 ' A' ' 92' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 . . . . . 0 CA--C 1.544 0.722 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -106.43 17.63 6.1 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.0 0 C-N-CA 126.127 1.771 . . . . 0.0 111.793 -170.338 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 53.7 t30 50.56 38.36 18.52 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 125.927 1.691 . . . . 0.0 112.94 -173.357 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 10.1 pm0 -80.78 173.37 12.67 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.728 1.611 . . . . 0.0 113.496 -171.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 18.9 m -116.95 167.37 10.12 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 126.033 1.733 . . . . 0.0 112.925 -170.351 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.3 ttp180 -90.76 130.21 41.73 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 124.876 1.27 . . . . 0.0 112.258 -174.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -70.38 176.51 7.14 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 124.09 3.194 . . . . 0.0 112.872 169.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -58.8 144.17 44.93 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.871 0.868 . . . . 0.0 109.786 173.283 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 86.1 mt -63.43 -38.6 41.2 Favored Pre-proline 0 N--CA 1.476 0.856 0 N-CA-C 114.697 1.369 . . . . 0.0 114.697 -169.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -62.98 -33.34 74.75 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 121.686 1.591 . . . . 0.0 113.217 170.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 8.8 tt -68.97 -45.19 71.29 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.387 0.994 . . . . 0.0 111.048 176.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.4 tt -52.33 -38.99 60.07 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.97 0.908 . . . . 0.0 111.333 169.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.59 -28.06 68.86 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.893 1.071 . . . . 0.0 113.893 176.44 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 65.2 mt -68.63 -40.41 81.73 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 CA-C-N 119.362 0.983 . . . . 0.0 110.648 171.122 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.7 mp -64.96 -37.6 88.17 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.144 -0.972 . . . . 0.0 111.005 173.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 17.9 m170 -64.09 -40.01 95.3 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.63 -0.669 . . . . 0.0 111.771 172.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.87 -29.34 70.54 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.991 0.917 . . . . 0.0 113.01 173.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.404 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -73.28 -2.49 22.19 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.227 1.011 . . . . 0.0 113.488 171.334 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.93 7.31 64.47 Favored Glycine 0 CA--C 1.536 1.361 0 C-N-CA 125.729 1.633 . . . . 0.0 114.978 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -106.56 109.45 21.37 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 118.777 1.289 . . . . 0.0 112.282 -175.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.8 tm0? -69.84 141.82 53.18 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.22 0.608 . . . . 0.0 110.149 170.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 172.01 168.17 33.13 Favored Glycine 0 N--CA 1.466 0.695 0 C-N-CA 123.595 0.617 . . . . 0.0 114.478 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -128.08 -57.91 1.23 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.389 1.476 . . . . 0.0 111.293 179.18 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 24.0 mtm -106.06 125.71 51.32 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.846 1.658 . . . . 0.0 111.876 -177.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -139.21 145.23 39.02 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.256 1.022 . . . . 0.0 113.417 -173.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 52.9 p -88.38 174.66 8.02 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 125.482 1.513 . . . . 0.0 111.848 169.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 2.6 t -56.25 -46.03 81.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 120.441 -1.412 . . . . 0.0 109.837 168.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 63.4 tttm -58.75 -40.49 84.0 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.871 0.868 . . . . 0.0 112.423 -179.154 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -74.98 -36.41 62.02 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 175.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 67.6 t -67.36 -58.35 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 CA-C-O 117.78 -1.105 . . . . 0.0 110.998 176.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.409 ' SD ' ' CD2' ' A' ' 200' ' ' 44Z . 16.1 mmt -60.59 -30.53 69.87 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-N 120.744 1.611 . . . . 0.0 112.889 -173.475 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -54.49 -59.09 5.15 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.704 173.323 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -74.72 -32.85 62.25 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 175.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.85 -40.67 60.87 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 120.801 -1.187 . . . . 0.0 112.043 -177.328 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.48 -40.69 99.05 Favored Glycine 0 CA--C 1.529 0.913 0 N-CA-C 111.604 -0.598 . . . . 0.0 111.604 171.494 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.8 tp60 -60.65 -45.01 95.71 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.13 0.972 . . . . 0.0 112.07 171.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.404 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 46.4 t80 -60.42 -51.6 68.81 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.347 1.059 . . . . 0.0 110.488 176.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 45.8 mt -61.58 -37.58 78.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 C-N-CA 124.024 0.929 . . . . 0.0 110.626 179.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -67.5 -42.28 83.1 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 119.425 1.011 . . . . 0.0 113.292 175.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.8 p -78.54 -30.08 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -177.218 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 21.9 mmtp -97.2 -12.4 23.07 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 125.112 1.365 . . . . 0.0 113.889 177.067 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.0 mp0 51.82 78.4 0.12 Allowed 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 126.95 2.1 . . . . 0.0 114.343 -176.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.6 tp -95.11 2.12 55.07 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.403 1.081 . . . . 0.0 112.884 177.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -102.04 162.17 13.12 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 127.627 2.371 . . . . 0.0 110.981 174.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -92.34 132.63 36.57 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 168.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.98 -29.02 64.91 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.165 0.893 . . . . 0.0 113.101 -176.627 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -78.34 -25.59 46.46 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.466 1.106 . . . . 0.0 111.862 -174.567 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -143.96 63.7 1.33 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 127.411 2.284 . . . . 0.0 110.127 -169.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -60.55 -20.0 59.03 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.823 0.849 . . . . 0.0 113.178 179.314 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 6.1 p-80 -66.28 -7.4 18.41 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.195 1.398 . . . . 0.0 113.867 169.411 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.6 ttm -124.95 143.48 50.86 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.438 1.895 . . . . 0.0 111.846 174.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.0 t -129.17 141.31 46.93 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 126.535 1.934 . . . . 0.0 108.878 -174.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -122.85 71.34 1.04 Allowed 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.582 1.153 . . . . 0.0 111.394 -171.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 3.5 m -87.71 8.1 27.08 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.185 1.18 . . . . 0.0 114.185 -173.092 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.42 -27.38 63.22 Favored Glycine 0 CA--C 1.54 1.6 0 O-C-N 120.852 -1.155 . . . . 0.0 114.64 179.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -89.43 3.89 83.91 Favored Glycine 0 CA--C 1.54 1.617 0 C-N-CA 125.186 1.374 . . . . 0.0 115.172 172.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -109.28 173.22 6.42 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.97 1.708 . . . . 0.0 112.508 -175.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.1 mp -53.17 -32.93 50.37 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.765 1.626 . . . . 0.0 113.041 169.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 95.8 mt -61.08 -47.51 85.99 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.102 -0.999 . . . . 0.0 111.397 170.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -63.61 -38.28 96.02 Favored Glycine 0 CA--C 1.531 1.053 0 CA-C-O 119.064 -0.853 . . . . 0.0 113.031 173.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.16 -29.24 62.71 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 119.903 1.851 . . . . 0.0 112.951 179.676 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.4 pp -80.66 -35.19 34.17 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 175.185 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.08 -7.49 23.16 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 119.266 0.939 . . . . 0.0 113.517 -177.817 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.08 -27.04 3.16 Favored Glycine 0 CA--C 1.541 1.659 0 O-C-N 120.164 -1.585 . . . . 0.0 113.35 -169.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.27 137.47 7.12 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 128.092 2.557 . . . . 0.0 110.789 177.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -144.75 56.36 1.27 Allowed 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 119.003 0.82 . . . . 0.0 110.608 169.331 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 6.7 m -102.78 129.24 49.37 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 168.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 52.3 p90 -163.4 173.8 12.75 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.693 1.197 . . . . 0.0 112.857 -168.057 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 52.9 p -119.97 146.14 46.11 Favored 'General case' 0 C--N 1.333 -0.139 0 C-N-CA 123.87 0.868 . . . . 0.0 112.984 172.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 14.4 m -77.68 -14.02 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 C-N-CA 123.157 0.583 . . . . 0.0 112.435 169.562 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 22.6 ttpp -64.73 -28.61 69.7 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.357 1.863 . . . . 0.0 112.598 169.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -117.55 77.47 10.72 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 126.46 1.904 . . . . 0.0 110.003 177.044 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -69.78 -24.78 29.18 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 123.613 2.875 . . . . 0.0 115.023 -169.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 48.8 m -60.4 -52.75 70.73 Favored Pre-proline 0 N--CA 1.477 0.886 0 CA-C-N 120.11 1.323 . . . . 0.0 114.124 -177.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -64.54 -32.33 59.18 Favored 'Trans proline' 0 CA--C 1.539 0.765 0 C-N-CA 122.109 1.872 . . . . 0.0 113.081 175.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 19.6 tp -65.38 -43.39 90.86 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 121.247 -0.908 . . . . 0.0 111.046 173.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -63.85 -37.4 87.26 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.745 0.818 . . . . 0.0 112.223 174.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -62.71 -47.51 83.28 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.836 0.854 . . . . 0.0 112.655 174.419 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.445 ' HB2' ' HE3' ' A' ' 101' ' ' MET . 32.0 mtm -58.99 -46.72 87.44 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.211 0.604 . . . . 0.0 112.223 171.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 59.0 mt -58.55 -47.18 85.07 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.064 0.946 . . . . 0.0 111.821 177.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 34.9 mtp180 -54.46 -25.11 23.22 Favored 'General case' 0 N--CA 1.482 1.168 0 CA-C-N 119.768 1.167 . . . . 0.0 113.535 173.059 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -91.55 -15.41 28.74 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 126.259 1.823 . . . . 0.0 114.655 176.331 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 14.6 p30 -116.29 -23.14 8.5 Favored 'General case' 0 N--CA 1.483 1.225 0 CA-C-N 120.485 1.493 . . . . 0.0 114.587 179.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 30.0 tp -113.26 95.84 5.59 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 128.405 2.682 . . . . 0.0 106.101 169.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 45.2 t -61.63 129.67 24.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.588 0.755 . . . . 0.0 110.477 -169.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 2.7 t -155.72 -164.01 1.63 Allowed 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.962 1.305 . . . . 0.0 110.765 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 7.5 mp -65.69 -160.43 0.02 OUTLIER 'General case' 0 CA--C 1.557 1.217 0 C-N-CA 127.401 2.28 . . . . 0.0 109.108 167.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . 62.35 18.29 10.14 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 116.469 2.025 . . . . 0.0 116.469 169.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 3.8 t . . . . . 0 N--CA 1.478 0.939 0 C-N-CA 125.677 1.591 . . . . 0.0 111.938 174.93 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 200' ' ' 44Z . . . . . 0.409 ' CD2' ' SD ' ' A' ' 53' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 50.6 mm-40 . . . . . 0 CA--C 1.541 0.625 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.8 pp -82.59 162.54 3.27 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 C-N-CA 125.852 1.661 . . . . 0.0 112.495 174.434 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 28.4 m120 -101.78 3.04 39.05 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.678 1.191 . . . . 0.0 113.616 -178.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.81 168.28 18.17 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.634 1.574 . . . . 0.0 113.044 -172.361 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 31.7 m -104.23 172.79 1.46 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 C-N-CA 128.161 2.585 . . . . 0.0 112.07 -174.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 95.4 mtm-85 -86.18 149.42 49.88 Favored Pre-proline 0 N--CA 1.48 1.037 0 O-C-N 121.004 -1.06 . . . . 0.0 111.217 -177.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -73.19 174.65 11.71 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 123.155 2.57 . . . . 0.0 111.823 169.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt -62.94 148.46 47.4 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.406 1.082 . . . . 0.0 110.054 177.112 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 94.0 mt -55.74 -46.73 99.7 Favored Pre-proline 0 N--CA 1.476 0.832 0 N-CA-C 115.24 1.57 . . . . 0.0 115.24 -168.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -66.4 -23.54 50.95 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 CA-C-N 122.509 1.932 . . . . 0.0 114.247 175.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.3 tt -71.78 -39.97 69.57 Favored 'General case' 0 N--CA 1.474 0.725 0 O-C-N 120.85 -1.156 . . . . 0.0 109.932 170.01 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 13.6 tp -61.58 -34.58 75.86 Favored 'General case' 0 CA--C 1.548 0.895 0 O-C-N 121.12 -0.987 . . . . 0.0 111.665 170.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.419 ' HA ' ' HE2' ' A' ' 35' ' ' LYS . 8.5 mmpt? -65.43 -39.34 91.97 Favored 'General case' 0 N--CA 1.481 1.095 0 O-C-N 121.147 -0.971 . . . . 0.0 112.649 170.012 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 52.6 mt -63.57 -38.88 83.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 124.401 1.08 . . . . 0.0 111.844 172.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.9 mt -61.52 -41.04 96.72 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 121.058 -1.026 . . . . 0.0 112.235 169.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 49.4 m170 -64.68 -41.93 95.7 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 121.494 -0.754 . . . . 0.0 112.209 172.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.91 -25.0 67.7 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.774 1.23 . . . . 0.0 113.331 177.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.424 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -71.44 -6.5 40.84 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.904 0.881 . . . . 0.0 113.313 171.684 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.03 12.73 59.9 Favored Glycine 0 CA--C 1.536 1.388 0 C-N-CA 125.177 1.37 . . . . 0.0 114.453 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -108.92 163.16 13.53 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.533 1.533 . . . . 0.0 112.813 -178.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -79.99 172.54 13.63 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 121.63 -0.669 . . . . 0.0 110.934 168.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -153.44 102.44 0.22 Allowed Glycine 0 N--CA 1.469 0.841 0 O-C-N 121.373 -0.829 . . . . 0.0 114.252 177.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -150.12 85.62 1.41 Allowed 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 126.805 2.042 . . . . 0.0 107.384 170.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.1 mpp? 67.22 135.46 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 131.49 3.916 . . . . 0.0 116.256 176.751 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -161.76 169.34 21.59 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.138 1.375 . . . . 0.0 112.788 177.309 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 82.1 p -91.09 171.65 9.11 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 126.55 1.94 . . . . 0.0 111.954 172.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -51.19 -42.23 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.317 0 O-C-N 121.288 -0.883 . . . . 0.0 111.537 172.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -62.57 -48.19 80.53 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.367 1.067 . . . . 0.0 112.544 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -73.64 -31.56 63.57 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -178.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 57.9 t -64.91 -46.31 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 O-C-N 121.615 -0.678 . . . . 0.0 110.647 169.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.9 ttm -69.29 -32.67 71.98 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 126.2 1.8 . . . . 0.0 114.114 -177.345 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -51.48 -49.7 61.3 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 122.974 0.51 . . . . 0.0 111.137 169.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 42.3 m-85 -74.71 -36.7 62.69 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 115.04 1.496 . . . . 0.0 115.04 171.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.1 mp -71.77 -36.95 70.52 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 120.87 1.668 . . . . 0.0 113.435 -177.42 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.13 -42.1 99.56 Favored Glycine 0 CA--C 1.533 1.18 0 CA-C-N 119.246 0.93 . . . . 0.0 111.688 170.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.9 tp60 -62.14 -42.69 99.5 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.644 1.178 . . . . 0.0 112.317 172.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.424 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 50.4 t80 -62.17 -52.34 64.2 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.743 1.217 . . . . 0.0 110.2 176.432 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 69.0 mt -58.68 -39.61 76.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 C-N-CA 123.954 0.902 . . . . 0.0 110.752 178.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.3 tpt -65.8 -44.19 86.41 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.351 1.06 . . . . 0.0 112.902 175.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.0 p -78.49 -27.77 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 CA-C-N 119.809 1.186 . . . . 0.0 113.399 -177.472 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 54.4 mmtt -89.73 -15.74 31.83 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.108 1.363 . . . . 0.0 113.268 173.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 13.9 mp0 51.86 57.88 6.05 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.815 2.046 . . . . 0.0 112.268 -171.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 13.8 tp -91.88 0.93 57.46 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.393 1.077 . . . . 0.0 112.533 -174.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 41.5 p90 -92.62 156.43 17.1 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.854 1.662 . . . . 0.0 111.177 171.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -80.41 122.71 27.3 Favored 'General case' 0 CA--C 1.541 0.634 0 O-C-N 121.579 -0.7 . . . . 0.0 110.86 172.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -59.53 -23.85 63.18 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 114.683 1.364 . . . . 0.0 114.683 177.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -91.35 -27.81 18.12 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 123.96 0.904 . . . . 0.0 112.154 -173.443 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -147.03 87.73 1.7 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.844 2.457 . . . . 0.0 109.605 178.328 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 29.6 mp0 -64.43 -12.03 39.22 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 -169.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 28.1 p80 -65.66 -24.79 67.11 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 170.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 20.6 tpp -86.14 132.02 34.12 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.239 1.416 . . . . 0.0 111.629 177.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 3.7 t -127.09 125.71 66.85 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 C-N-CA 127.01 2.124 . . . . 0.0 109.49 178.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 23.2 t80 -101.14 46.84 0.93 Allowed 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.64 1.176 . . . . 0.0 113.244 -169.626 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 85.2 m -64.88 -9.65 22.58 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 120.467 -1.396 . . . . 0.0 113.848 -179.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -54.98 -22.79 29.13 Favored Glycine 0 CA--C 1.541 1.687 0 C-N-CA 124.78 1.181 . . . . 0.0 113.776 169.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -86.72 1.98 87.15 Favored Glycine 0 CA--C 1.541 1.71 0 C-N-CA 125.228 1.394 . . . . 0.0 116.148 173.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -131.69 -173.62 3.18 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 120.1 1.95 . . . . 0.0 113.769 -175.217 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 7.5 mp -47.15 -40.52 15.89 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.949 1.699 . . . . 0.0 113.532 179.081 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.5 tp -68.57 -32.4 72.29 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-O 121.617 0.722 . . . . 0.0 111.256 178.625 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -73.15 -36.0 56.74 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 126.64 2.067 . . . . 0.0 114.51 173.442 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -66.37 -42.36 88.09 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.861 1.83 . . . . 0.0 110.161 170.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 27.7 tp -59.25 -51.45 69.93 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.677 1.191 . . . . 0.0 112.332 178.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.22 -10.98 26.74 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 114.91 1.448 . . . . 0.0 114.91 -177.303 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.0 -20.04 7.06 Favored Glycine 0 CA--C 1.539 1.584 0 C-N-CA 125.931 1.729 . . . . 0.0 115.638 -179.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.09 30.57 0.49 Allowed 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -175.207 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 5.6 tp60 -70.45 44.79 0.08 Allowed 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 116.4 2.0 . . . . 0.0 116.4 -168.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 21.2 m -105.61 138.36 41.94 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 120.778 -1.201 . . . . 0.0 108.973 169.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 45.7 p90 -157.24 167.94 28.87 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 -167.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 50.1 m -115.09 136.02 53.57 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 113.936 -1.484 . . . . 0.0 109.841 175.3 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.538 HG21 ' CE5' ' A' ' 200' ' ' 44Z . 24.4 m -77.53 -20.05 14.05 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.344 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -178.823 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -74.8 -6.25 47.94 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 126.484 1.913 . . . . 0.0 115.171 -178.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -121.16 87.89 44.66 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 126.439 1.896 . . . . 0.0 109.476 -177.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -63.33 -31.34 73.35 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 123.93 3.086 . . . . 0.0 115.273 -169.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 70.0 m -61.5 -55.91 38.34 Favored Pre-proline 0 N--CA 1.477 0.89 0 CA-C-N 120.12 1.327 . . . . 0.0 113.825 -177.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -67.17 -27.17 41.81 Favored 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 121.817 1.678 . . . . 0.0 112.63 175.219 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.416 HD11 ' CE3' ' A' ' 200' ' ' 44Z . 27.9 tp -65.55 -45.93 81.5 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.634 0.774 . . . . 0.0 111.158 175.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -63.48 -36.33 83.4 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.627 -0.671 . . . . 0.0 112.564 173.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -59.92 -46.3 89.8 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 119.355 0.98 . . . . 0.0 112.079 176.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.403 ' HE3' ' HB2' ' A' ' 101' ' ' MET . 29.0 mtm -62.09 -49.86 74.25 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 171.637 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -64.94 -46.76 80.23 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 118.042 -0.98 . . . . 0.0 111.053 -171.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -58.19 -23.6 56.11 Favored 'General case' 0 N--CA 1.482 1.14 0 CA-C-N 119.975 1.261 . . . . 0.0 113.338 175.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -90.49 -18.74 24.78 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.968 1.707 . . . . 0.0 114.806 174.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -121.86 -26.68 4.78 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-N 119.843 1.201 . . . . 0.0 114.145 -171.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 3.3 tt -124.79 96.2 4.8 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 127.631 2.373 . . . . 0.0 107.188 174.703 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 33.5 t -58.58 132.24 23.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 C-N-CA 123.623 0.769 . . . . 0.0 111.069 -170.1 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 6.3 t -148.28 -174.76 4.67 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.152 1.381 . . . . 0.0 111.948 -172.42 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -91.88 26.86 2.27 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.498 1.919 . . . . 0.0 115.503 -168.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -139.12 157.14 46.48 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.825 1.25 . . . . 0.0 114.269 -172.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 8.9 t . . . . . 0 N--CA 1.479 0.992 0 C-N-CA 125.651 1.58 . . . . 0.0 113.795 -176.159 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 200' ' ' 44Z . . . . . 0.538 ' CE5' HG21 ' A' ' 92' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 . . . . . 0 CA--C 1.542 0.671 0 N-CA-C 112.489 0.551 . . . . 0.0 112.489 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.7 mt -133.04 151.56 34.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 125.873 1.669 . . . . 0.0 109.558 -179.275 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 69.2 m-80 -107.74 49.85 0.79 Allowed 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.424 1.49 . . . . 0.0 111.036 172.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 7.9 pm0 -80.75 166.63 20.82 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.669 1.587 . . . . 0.0 113.209 -176.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 17.8 m -131.66 157.48 43.17 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 125.573 1.549 . . . . 0.0 113.526 -169.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 30.9 ttm105 -86.69 143.1 35.26 Favored Pre-proline 0 N--CA 1.48 1.075 0 C-N-CA 124.796 1.238 . . . . 0.0 112.56 -172.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -65.81 166.83 19.09 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 122.606 2.204 . . . . 0.0 111.953 168.33 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 27.8 ttpt -72.53 157.67 37.15 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 170.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.3 mp -50.4 -47.5 83.27 Favored Pre-proline 0 N--CA 1.473 0.696 0 N-CA-C 115.252 1.575 . . . . 0.0 115.252 -168.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_exo -66.19 -28.99 47.79 Favored 'Trans proline' 0 C--N 1.348 0.522 0 CA-C-N 121.689 1.639 . . . . 0.0 113.732 178.414 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.4 tt -74.11 -38.62 63.77 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.37 -0.831 . . . . 0.0 109.606 177.266 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 23.1 tp -60.2 -35.59 75.75 Favored 'General case' 0 CA--C 1.55 0.956 0 O-C-N 121.521 -0.737 . . . . 0.0 111.341 170.115 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.4 mmtp -69.62 -36.51 76.21 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 121.386 -0.821 . . . . 0.0 112.552 174.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.29 -38.65 81.66 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.495 0.718 . . . . 0.0 110.921 170.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.5 mp -64.13 -39.95 95.14 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.029 -1.045 . . . . 0.0 113.116 171.155 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 35.6 m170 -58.81 -47.32 85.17 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 119.592 1.087 . . . . 0.0 111.497 170.087 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.16 -25.15 68.22 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 177.098 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.469 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -67.62 -15.22 63.54 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.067 0.947 . . . . 0.0 113.322 172.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 89.47 12.59 62.68 Favored Glycine 0 CA--C 1.537 1.413 0 C-N-CA 125.06 1.314 . . . . 0.0 113.883 -169.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -98.67 157.5 16.22 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.893 1.277 . . . . 0.0 111.662 176.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.8 tp60 -80.38 164.42 23.11 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.658 0.783 . . . . 0.0 111.36 174.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -82.08 -156.78 18.86 Favored Glycine 0 CA--C 1.537 1.462 0 N-CA-C 115.809 1.084 . . . . 0.0 115.809 174.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 61.0 66.16 0.93 Allowed 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 127.611 2.364 . . . . 0.0 116.592 173.39 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . 0.401 0.9 OUTLIER 51.38 146.05 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.275 1 N-CA-C 121.967 4.062 . . . . 0.0 121.967 168.307 . . . . . . . . 4 3 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -157.53 172.15 19.08 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.559 1.543 . . . . 0.0 112.596 -168.416 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 40.0 p -81.66 168.78 17.77 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 124.475 1.11 . . . . 0.0 112.067 171.058 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -57.92 -41.06 79.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 120.22 -1.55 . . . . 0.0 110.663 172.406 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -59.42 -31.77 69.58 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.666 0.786 . . . . 0.0 112.709 178.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -80.55 -53.16 6.81 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.082 0.953 . . . . 0.0 112.903 170.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 88.5 t -56.08 -52.3 51.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 123.776 0.83 . . . . 0.0 111.275 -176.42 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 26.7 mmm -73.15 -30.64 63.73 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -172.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 54.9 t-80 -61.58 -48.24 81.83 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.583 170.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -64.54 -38.95 92.79 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 121.743 -0.598 . . . . 0.0 112.389 173.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.98 -38.78 92.11 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 121.187 -0.946 . . . . 0.0 111.448 175.055 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.74 -39.14 97.17 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 125.385 1.469 . . . . 0.0 112.885 172.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 11.9 tp60 -60.94 -48.64 80.87 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.757 1.223 . . . . 0.0 111.091 169.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.469 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 33.5 t80 -56.54 -48.96 76.17 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.122 -0.986 . . . . 0.0 110.735 174.218 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 47.0 mt -59.63 -36.76 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 125.228 1.411 . . . . 0.0 111.935 177.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.5 tpt -68.12 -36.5 79.84 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.718 1.207 . . . . 0.0 112.231 174.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 94.2 t -78.18 -33.41 17.84 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 124.063 0.945 . . . . 0.0 112.677 178.458 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 48.2 mmtt -89.84 -14.82 33.56 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.752 1.221 . . . . 0.0 113.222 178.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.6 mp0 50.02 63.94 1.99 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 127.627 2.371 . . . . 0.0 113.088 -171.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 14.3 tp -91.26 -1.59 57.64 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.149 0.98 . . . . 0.0 113.295 -175.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 55.1 p90 -90.25 156.22 18.45 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.551 1.54 . . . . 0.0 111.923 178.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -76.83 128.64 34.97 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.816 -0.553 . . . . 0.0 111.136 171.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.6 pm0 -69.68 -27.22 64.83 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 115.271 1.582 . . . . 0.0 115.271 -171.171 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -96.08 -26.92 15.32 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 119.165 0.893 . . . . 0.0 111.891 -177.315 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -136.19 79.75 1.79 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.669 1.988 . . . . 0.0 111.178 176.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 29.7 mp0 -60.89 -12.73 12.0 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -173.428 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 23.9 p80 -62.38 -25.76 68.1 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 118.94 0.791 . . . . 0.0 112.786 170.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 18.2 tpp -83.6 129.17 34.96 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.069 1.347 . . . . 0.0 110.955 172.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.4 t -119.01 117.57 54.73 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 125.991 1.716 . . . . 0.0 107.856 174.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -102.09 65.74 0.99 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.213 1.005 . . . . 0.0 112.165 -169.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 2.7 m -79.32 3.91 16.77 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 114.258 1.207 . . . . 0.0 114.258 -173.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.95 -26.08 54.48 Favored Glycine 0 CA--C 1.542 1.727 0 CA-C-N 119.927 1.24 . . . . 0.0 114.316 171.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -91.68 7.34 79.68 Favored Glycine 0 CA--C 1.542 1.738 0 C-N-CA 125.437 1.494 . . . . 0.0 115.374 172.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -112.74 170.31 8.28 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.181 1.792 . . . . 0.0 112.537 -174.13 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.9 tt -46.53 -43.17 16.72 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.63 1.572 . . . . 0.0 111.089 169.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 96.3 mt -55.13 -43.23 73.93 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.248 1.019 . . . . 0.0 112.522 173.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -70.64 -39.1 67.61 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 124.984 1.278 . . . . 0.0 113.62 177.275 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -63.52 -42.61 98.46 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 120.363 2.082 . . . . 0.0 110.696 174.074 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 40.2 tp -62.7 -51.59 66.6 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.976 1.711 . . . . 0.0 112.52 -178.477 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -97.26 -8.48 29.73 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 -176.251 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 82.69 -24.68 4.94 Favored Glycine 0 CA--C 1.54 1.613 0 C-N-CA 125.492 1.52 . . . . 0.0 113.126 -169.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.18 137.21 10.39 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 127.049 2.14 . . . . 0.0 111.611 175.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -148.44 45.1 1.04 Allowed 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.153 0.981 . . . . 0.0 110.161 169.05 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 11.5 m -99.51 131.17 45.69 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 120.933 -1.104 . . . . 0.0 110.368 170.115 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 35.7 p90 -165.16 178.78 6.74 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.589 1.555 . . . . 0.0 111.98 -168.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 77.3 p -127.21 143.88 51.16 Favored 'General case' 0 N--CA 1.456 -0.162 0 N-CA-C 114.63 1.345 . . . . 0.0 114.63 174.157 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.456 HG21 ' CE5' ' A' ' 200' ' ' 44Z . 21.3 m -72.1 -16.84 18.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 N-CA-C 114.042 1.127 . . . . 0.0 114.042 -173.792 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.5 pttt -74.43 -9.49 58.64 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.854 1.662 . . . . 0.0 114.108 172.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -121.09 79.84 34.59 Favored Pre-proline 0 CA--C 1.549 0.906 0 C-N-CA 126.091 1.757 . . . . 0.0 110.154 -179.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.14 -28.52 28.11 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 123.449 2.766 . . . . 0.0 114.712 -169.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 59.2 m -57.51 -54.14 58.17 Favored Pre-proline 0 N--CA 1.477 0.882 0 CA-C-N 120.147 1.339 . . . . 0.0 113.721 -177.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -66.16 -27.26 49.17 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 121.889 1.726 . . . . 0.0 112.854 174.323 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.21 -53.41 57.31 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.255 1.022 . . . . 0.0 110.568 175.295 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -63.77 -32.45 73.96 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.72 0.808 . . . . 0.0 112.52 173.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -62.47 -43.85 97.81 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 120.123 1.329 . . . . 0.0 112.844 175.116 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 23.5 mtm -63.5 -49.67 72.64 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.023 0.529 . . . . 0.0 111.729 171.475 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.8 mp -62.43 -36.78 83.46 Favored 'General case' 0 C--O 1.219 -0.547 0 CA-C-O 117.696 -1.145 . . . . 0.0 111.808 -177.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 -55.1 -24.49 25.9 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 121.336 1.88 . . . . 0.0 113.662 171.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -89.99 -15.08 32.65 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 125.367 1.467 . . . . 0.0 114.559 173.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -132.37 2.69 3.88 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 115.595 1.702 . . . . 0.0 115.595 -177.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 62.0 tp -145.78 143.36 29.65 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 128.251 2.62 . . . . 0.0 108.573 -178.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 65.2 t -75.96 95.49 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 171.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 5.9 t -156.55 -174.14 4.8 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.432 1.493 . . . . 0.0 111.767 -175.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -104.35 169.54 8.42 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 127.386 2.275 . . . . 0.0 110.626 -176.21 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -84.53 4.57 31.36 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 115.712 1.745 . . . . 0.0 115.712 -174.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 78.1 p . . . . . 0 N--CA 1.471 0.588 0 C-N-CA 125.454 1.501 . . . . 0.0 112.17 -168.167 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 200' ' ' 44Z . . . . . 0.456 ' CE5' HG21 ' A' ' 92' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 . . . . . 0 CA--C 1.542 0.672 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 57.7 mt -109.76 138.69 36.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 125.4 1.48 . . . . 0.0 109.686 -179.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 51.4 t-20 -76.26 110.35 10.7 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.793 0.837 . . . . 0.0 110.609 173.603 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -151.98 171.84 17.19 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.821 1.648 . . . . 0.0 111.827 -179.407 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.6 m -127.77 172.2 14.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 126.252 1.821 . . . . 0.0 111.84 -178.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -81.8 140.91 47.34 Favored Pre-proline 0 N--CA 1.481 1.121 0 C-N-CA 124.547 1.139 . . . . 0.0 112.941 -169.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -70.28 175.6 8.31 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 123.793 2.995 . . . . 0.0 113.791 175.003 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 17.3 ttmt -60.56 147.27 42.14 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.564 1.145 . . . . 0.0 109.617 172.253 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 73.6 mt -57.12 -47.05 99.73 Favored Pre-proline 0 N--CA 1.474 0.744 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 -167.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -66.82 -23.63 47.71 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 CA-C-N 121.8 1.679 . . . . 0.0 114.609 176.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.409 ' C ' HD23 ' A' ' 33' ' ' LEU . 5.6 tt -65.92 -44.11 86.12 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 120.057 1.299 . . . . 0.0 109.31 172.61 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 36.6 tp -62.13 -39.99 94.42 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 121.738 -0.601 . . . . 0.0 111.729 172.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.8 mmpt? -61.28 -39.81 91.81 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.339 0.655 . . . . 0.0 112.698 174.04 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 63.5 mt -64.33 -35.56 74.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 124.355 1.062 . . . . 0.0 112.224 174.402 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.1 mt -70.65 -34.87 72.51 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 119.666 1.121 . . . . 0.0 111.944 171.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 50.9 m170 -61.19 -42.32 98.36 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.053 0.842 . . . . 0.0 111.275 169.48 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.66 -24.86 67.72 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.512 1.125 . . . . 0.0 113.513 175.023 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.458 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -71.51 -7.02 44.91 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 124.155 0.982 . . . . 0.0 113.141 171.284 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 85.49 12.78 71.92 Favored Glycine 0 CA--C 1.537 1.421 0 C-N-CA 125.205 1.383 . . . . 0.0 114.146 -173.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -106.3 140.9 38.51 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.955 1.302 . . . . 0.0 112.637 -176.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -76.66 162.55 27.64 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 121.721 -0.612 . . . . 0.0 110.479 169.036 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -162.99 130.42 2.24 Favored Glycine 0 CA--C 1.526 0.747 0 O-C-N 121.432 -0.792 . . . . 0.0 114.982 -178.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -142.17 66.68 1.33 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 126.227 1.811 . . . . 0.0 109.162 173.276 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . 0.419 0.6 OUTLIER 63.38 145.86 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 129.537 3.135 . . . . 0.0 118.191 -175.013 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -162.72 169.55 19.81 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.089 1.756 . . . . 0.0 113.07 -168.745 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 41.8 p -79.96 171.37 15.19 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 125.244 1.418 . . . . 0.0 112.01 169.5 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -59.52 -39.19 78.68 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 O-C-N 120.549 -1.345 . . . . 0.0 111.676 173.736 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -62.18 -45.57 92.82 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.272 1.429 . . . . 0.0 112.724 176.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -68.76 -38.88 80.42 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.259 0.624 . . . . 0.0 112.176 176.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 8.5 t -58.37 -45.3 89.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 124.689 1.196 . . . . 0.0 111.126 170.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -69.3 -33.97 73.98 Favored 'General case' 0 CA--C 1.519 -0.242 0 C-N-CA 126.942 2.097 . . . . 0.0 114.512 -172.425 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -51.56 -49.29 62.32 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 120.699 0.285 . . . . 0.0 111.149 169.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -74.77 -32.26 62.01 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 172.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.91 -40.79 78.89 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 120.431 1.469 . . . . 0.0 112.43 178.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -60.18 -45.62 95.71 Favored Glycine 0 CA--C 1.529 0.919 0 N-CA-C 111.269 -0.732 . . . . 0.0 111.269 171.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 11.0 tp60 -58.32 -42.61 87.12 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.269 1.028 . . . . 0.0 112.582 173.294 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.458 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 56.3 t80 -61.13 -50.12 74.48 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.078 0.951 . . . . 0.0 110.544 174.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 72.4 mt -61.44 -37.13 77.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 123.781 0.833 . . . . 0.0 111.154 178.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 34.3 mmt -67.58 -42.97 81.65 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 119.502 1.046 . . . . 0.0 113.256 174.183 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.3 p -78.49 -27.42 14.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 CA-C-N 119.738 1.154 . . . . 0.0 113.267 -176.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 56.4 mmtt -93.24 -15.69 25.6 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.266 1.427 . . . . 0.0 113.566 174.134 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 14.8 mp0 54.36 61.29 3.09 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.68 1.992 . . . . 0.0 113.022 -175.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.2 tp -94.4 10.12 35.6 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.48 1.112 . . . . 0.0 112.873 -176.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 25.1 p90 -113.26 155.43 25.1 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 127.128 2.171 . . . . 0.0 111.49 -178.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -80.96 129.64 34.63 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 122.048 -0.408 . . . . 0.0 110.174 169.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 7.7 pm0 -59.02 -33.88 71.24 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -173.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -108.02 -27.88 9.88 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.498 1.119 . . . . 0.0 112.185 -171.406 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -109.14 56.5 0.62 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.763 2.025 . . . . 0.0 111.019 171.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -60.71 -18.63 55.43 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 124.494 1.118 . . . . 0.0 113.434 -175.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 29.6 p80 -63.26 -14.8 53.56 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.584 1.154 . . . . 0.0 114.013 171.367 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 13.8 ttm -111.64 141.72 44.87 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.007 1.323 . . . . 0.0 112.132 172.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.5 t -122.99 133.3 69.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 126.258 1.823 . . . . 0.0 108.821 175.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 6.6 t80 -113.32 52.07 0.81 Allowed 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.77 0.795 . . . . 0.0 112.968 -169.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 4.9 m -71.52 -6.37 40.12 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 -175.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -55.54 -25.54 42.69 Favored Glycine 0 CA--C 1.541 1.657 0 C-N-CA 125.439 1.495 . . . . 0.0 115.148 177.165 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -88.47 0.24 82.95 Favored Glycine 0 CA--C 1.541 1.658 0 C-N-CA 125.051 1.31 . . . . 0.0 115.601 175.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -131.92 -176.07 3.93 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 126.067 1.747 . . . . 0.0 112.072 -171.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -46.71 -47.05 20.55 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.833 2.053 . . . . 0.0 113.871 -170.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 94.0 mt -60.08 -37.81 81.03 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.81 1.244 . . . . 0.0 112.564 175.162 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -73.16 -34.24 58.42 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 125.697 1.617 . . . . 0.0 114.311 175.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -66.51 -42.39 87.42 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 119.68 1.74 . . . . 0.0 110.444 171.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 32.9 tp -61.53 -50.77 71.33 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.401 1.48 . . . . 0.0 112.524 179.049 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -99.02 -14.27 19.53 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 115.154 1.538 . . . . 0.0 115.154 -175.442 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 82.35 -19.1 11.37 Favored Glycine 0 CA--C 1.541 1.665 0 C-N-CA 125.729 1.633 . . . . 0.0 116.114 179.448 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.0 24.12 1.18 Allowed 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 -176.794 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -71.26 52.65 0.18 Allowed 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 117.533 2.42 . . . . 0.0 117.533 -167.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 36.0 m -117.79 139.06 51.6 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.235 1.014 . . . . 0.0 108.53 168.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 45.8 p90 -159.34 167.12 29.66 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -167.245 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 2.1 m -99.91 136.29 40.05 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.608 1.563 . . . . 0.0 110.328 169.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.55 HG21 ' CD5' ' A' ' 200' ' ' 44Z . 6.9 m -77.6 -19.87 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 124.399 1.079 . . . . 0.0 112.803 175.039 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 61.3 pttt -80.56 -2.94 48.38 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 127.592 2.357 . . . . 0.0 115.114 -179.256 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.401 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 48.9 t0 -125.94 94.26 42.17 Favored Pre-proline 0 CA--C 1.549 0.92 0 C-N-CA 126.592 1.957 . . . . 0.0 110.267 -171.36 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 94' ' ' ASP . 20.3 Cg_endo -61.5 -31.39 87.66 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 123.936 3.091 . . . . 0.0 115.529 -174.799 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 66.8 m -58.53 -53.1 69.65 Favored Pre-proline 0 N--CA 1.477 0.882 0 CA-C-N 119.92 1.236 . . . . 0.0 114.057 -178.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -68.39 -24.33 36.99 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 122.034 1.823 . . . . 0.0 113.49 174.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 61.5 mt -65.9 -47.08 75.99 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 119.522 1.055 . . . . 0.0 111.058 174.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -58.13 -41.3 83.36 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 178.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -58.74 -51.72 68.77 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 118.963 0.801 . . . . 0.0 112.487 176.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 34.0 mtm -64.16 -49.69 71.09 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.266 0.626 . . . . 0.0 112.287 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.4 mp -63.61 -49.38 73.54 Favored 'General case' 0 C--O 1.224 -0.263 0 C-N-CA 124.568 1.147 . . . . 0.0 110.756 -176.682 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -60.32 -19.21 54.39 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 120.238 1.381 . . . . 0.0 113.647 178.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -96.74 -14.14 22.21 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.948 1.699 . . . . 0.0 114.435 175.126 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -118.23 -21.39 8.19 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-N 120.047 1.294 . . . . 0.0 113.742 -178.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 43.8 tp -117.36 130.17 56.34 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 127.225 2.21 . . . . 0.0 107.787 169.26 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 62.0 t -71.15 109.44 3.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 175.018 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 10.8 t -157.45 169.14 25.37 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 125.178 1.391 . . . . 0.0 111.537 -178.229 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.555 ' H ' HD13 ' A' ' 109' ' ' LEU . 0.0 OUTLIER -79.08 171.75 14.76 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.367 1.467 . . . . 0.0 114.258 179.908 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -120.64 15.1 11.89 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.827 1.651 . . . . 0.0 114.771 -169.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 8.0 t . . . . . 0 N--CA 1.479 1.003 0 C-N-CA 125.462 1.505 . . . . 0.0 112.955 -174.792 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 200' ' ' 44Z . . . . . 0.55 ' CD5' HG21 ' A' ' 92' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 54.3 mm-40 . . . . . 0 CA--C 1.538 0.511 0 CA-C-O 122.123 0.964 . . . . 0.0 112.794 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 17.4 pt -80.62 163.79 3.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 127.787 2.435 . . . . 0.0 114.29 -175.018 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 40.7 p-10 -86.94 2.49 49.19 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 125.57 1.548 . . . . 0.0 114.356 175.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 30.4 mm100 -78.34 174.58 11.1 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.554 1.541 . . . . 0.0 111.873 175.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 35.0 m -124.47 172.09 12.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 125.398 1.479 . . . . 0.0 111.904 -173.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 37.6 mtm180 -91.39 145.25 31.04 Favored Pre-proline 0 N--CA 1.479 1.01 0 C-N-CA 124.405 1.082 . . . . 0.0 112.482 -175.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -75.78 177.92 8.09 Favored 'Trans proline' 0 CA--C 1.54 0.807 0 C-N-CA 124.152 3.235 . . . . 0.0 111.499 169.324 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.7 ttmt -69.24 148.53 49.68 Favored 'General case' 0 CA--C 1.536 0.442 0 O-C-N 121.638 -0.664 . . . . 0.0 111.237 178.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 10.0 mp -53.67 -55.17 38.17 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 125.133 1.373 . . . . 0.0 114.548 -169.236 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -65.46 -22.0 59.7 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 122.297 1.998 . . . . 0.0 113.845 175.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.0 tt -75.21 -32.41 61.18 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 119.88 1.218 . . . . 0.0 110.988 172.573 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.3 tp -63.69 -37.31 86.88 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.308 -0.87 . . . . 0.0 111.017 169.189 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.42 ' HA ' ' HE2' ' A' ' 35' ' ' LYS . 8.9 mmpt? -62.61 -37.62 86.96 Favored 'General case' 0 N--CA 1.479 0.998 0 O-C-N 121.674 -0.641 . . . . 0.0 112.34 173.241 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 90.4 mt -62.94 -39.0 83.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 124.067 0.947 . . . . 0.0 111.467 172.507 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.3 mp -70.35 -33.06 71.01 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 120.715 -1.241 . . . . 0.0 113.332 172.175 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 63.5 m170 -64.46 -41.36 96.56 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 120.957 -1.09 . . . . 0.0 111.401 170.388 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.28 -24.12 67.72 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.013 0.925 . . . . 0.0 113.323 172.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.488 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -72.09 -9.12 57.97 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 123.955 0.902 . . . . 0.0 113.425 172.158 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.51 7.75 64.75 Favored Glycine 0 CA--C 1.538 1.491 0 C-N-CA 125.4 1.476 . . . . 0.0 114.572 -175.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -94.08 166.54 12.08 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.67 1.188 . . . . 0.0 113.08 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.1 tm0? -126.53 144.53 50.84 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.839 1.656 . . . . 0.0 108.973 169.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -174.71 165.48 36.79 Favored Glycine 0 C--N 1.339 0.711 0 N-CA-C 116.496 1.358 . . . . 0.0 116.496 -170.416 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -141.26 -65.38 0.43 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.408 1.883 . . . . 0.0 109.18 169.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 25.9 mtm -106.29 142.76 35.43 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 127.811 2.445 . . . . 0.0 112.169 -178.069 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -157.4 162.95 39.03 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.062 0.945 . . . . 0.0 113.419 -173.714 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 81.2 p -94.97 172.85 7.9 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.613 1.165 . . . . 0.0 108.366 166.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -57.4 -46.88 85.62 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.426 0 O-C-N 120.082 -1.636 . . . . 0.0 109.817 169.45 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -55.97 -39.89 72.45 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.786 1.234 . . . . 0.0 112.649 -179.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -74.2 -37.29 63.93 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 175.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 97.0 t -68.71 -49.66 62.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 CA-C-N 119.946 1.248 . . . . 0.0 111.978 175.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 11.5 mmm -67.63 -28.05 67.4 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 119.229 0.922 . . . . 0.0 112.99 -170.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -53.44 -54.03 42.77 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 114.84 -1.073 . . . . 0.0 111.355 169.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -74.35 -35.22 63.57 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 176.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.32 -37.56 77.79 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 121.131 -0.98 . . . . 0.0 112.107 178.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -64.99 -42.82 96.6 Favored Glycine 0 CA--C 1.529 0.929 0 C-N-CA 124.588 1.09 . . . . 0.0 112.054 172.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 30.4 tp60 -57.94 -44.54 87.01 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.046 0.938 . . . . 0.0 111.641 169.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.488 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 70.9 t80 -60.86 -52.18 66.13 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.505 0.722 . . . . 0.0 111.304 176.257 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 25.8 mt -58.79 -36.83 62.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 124.376 1.07 . . . . 0.0 111.371 177.324 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.6 tpt -66.39 -45.04 81.38 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 125.206 1.402 . . . . 0.0 112.684 175.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.7 p -78.51 -27.28 14.14 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 CA-C-N 119.709 1.14 . . . . 0.0 113.488 -177.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 53.7 mmtt -90.97 -15.74 29.18 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 125.287 1.435 . . . . 0.0 113.494 173.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 16.0 mp0 54.69 63.94 1.98 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 127.412 2.285 . . . . 0.0 113.417 -175.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.7 mt -91.86 -8.13 47.38 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.59 0.756 . . . . 0.0 113.007 176.133 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 54.2 p90 -76.61 153.39 35.32 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.845 0.858 . . . . 0.0 111.072 170.028 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -82.82 130.81 35.18 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 121.719 -0.613 . . . . 0.0 110.828 171.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -64.11 -25.36 68.06 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 120.969 -1.082 . . . . 0.0 113.353 -177.73 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -91.69 -22.72 20.09 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 123.923 0.889 . . . . 0.0 111.671 -172.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -149.84 75.42 1.25 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 129.327 3.051 . . . . 0.0 109.662 -174.067 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 29.9 mp0 -60.7 -18.64 55.42 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -173.405 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 1.6 p-80 -63.7 -29.74 70.93 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 113.469 0.915 . . . . 0.0 113.469 169.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 16.9 tpp -81.35 130.01 34.86 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.515 1.126 . . . . 0.0 110.532 171.584 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.5 t -124.81 117.38 50.1 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 C-N-CA 126.099 1.76 . . . . 0.0 108.664 177.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -96.77 73.53 2.65 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.165 1.386 . . . . 0.0 110.713 -177.163 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 72.5 m -76.76 -0.81 25.16 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 121.208 -0.932 . . . . 0.0 112.944 171.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.58 -25.63 58.62 Favored Glycine 0 CA--C 1.541 1.685 0 O-C-N 120.557 -1.34 . . . . 0.0 113.879 169.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -87.56 3.77 86.19 Favored Glycine 0 CA--C 1.542 1.731 0 C-N-CA 125.32 1.438 . . . . 0.0 115.224 171.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -107.57 167.51 9.9 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 126.231 1.812 . . . . 0.0 112.438 -176.372 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.9 tp -46.61 -43.0 17.0 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.184 1.794 . . . . 0.0 111.917 169.152 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 13.9 tp -59.38 -41.35 89.15 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.412 1.485 . . . . 0.0 111.74 175.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -65.16 -42.35 96.49 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 124.935 1.255 . . . . 0.0 113.834 171.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -63.33 -47.31 82.74 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 120.211 2.006 . . . . 0.0 110.679 177.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.4 pp -70.36 -32.49 70.2 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -176.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.15 -9.04 31.58 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 119.783 1.174 . . . . 0.0 112.854 175.228 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 80.43 -26.5 3.03 Favored Glycine 0 CA--C 1.541 1.659 0 C-N-CA 125.909 1.718 . . . . 0.0 113.437 -171.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -161.27 134.84 6.61 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 128.741 2.817 . . . . 0.0 109.425 176.25 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -142.6 28.56 1.61 Allowed 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 119.132 0.878 . . . . 0.0 111.32 174.01 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.2 m -91.78 142.69 27.31 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 121.591 -0.693 . . . . 0.0 111.95 -178.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 50.0 p90 -160.97 169.44 22.56 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.315 1.046 . . . . 0.0 112.41 -169.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 5.3 t -125.01 136.49 53.76 Favored 'General case' 0 N--CA 1.462 0.148 0 C-N-CA 123.584 0.754 . . . . 0.0 110.755 169.305 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 33.9 m -71.35 -11.69 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 N-CA-C 114.325 1.231 . . . . 0.0 114.325 -174.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -73.88 -11.21 60.29 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.338 1.055 . . . . 0.0 113.549 169.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 47.0 t0 -121.39 77.71 35.36 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 126.9 2.08 . . . . 0.0 109.303 179.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -71.39 -28.26 18.29 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 123.478 2.786 . . . . 0.0 115.017 -169.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 49.8 m -57.35 -52.26 75.56 Favored Pre-proline 0 N--CA 1.477 0.898 0 CA-C-N 119.987 1.267 . . . . 0.0 114.25 -177.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -66.47 -30.63 43.54 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 122.193 1.929 . . . . 0.0 113.239 176.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 40.8 tp -65.55 -48.29 72.93 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.281 1.032 . . . . 0.0 110.312 175.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -60.45 -41.48 94.17 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 118.484 -0.769 . . . . 0.0 112.405 172.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -58.28 -47.53 83.34 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 120.128 1.331 . . . . 0.0 112.645 -179.717 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 46.0 mtm -66.32 -49.6 66.46 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.461 0.705 . . . . 0.0 112.314 175.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.7 mp -65.58 -37.16 85.87 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-O 117.957 -1.021 . . . . 0.0 111.571 -177.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 91.4 mtt180 -55.43 -22.7 21.45 Favored 'General case' 0 N--CA 1.484 1.226 0 CA-C-N 120.732 1.606 . . . . 0.0 113.828 169.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -92.16 -16.24 26.54 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.792 1.637 . . . . 0.0 113.709 175.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -128.72 -10.83 4.96 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 116.185 1.921 . . . . 0.0 116.185 -176.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.551 HD23 ' H ' ' A' ' 107' ' ' VAL . 2.1 tt -140.95 164.36 30.46 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.84 2.056 . . . . 0.0 111.315 -167.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . 0.551 ' H ' HD23 ' A' ' 106' ' ' LEU . 20.8 t -74.81 67.11 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 126.292 1.837 . . . . 0.0 111.117 176.425 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 16.3 m -108.08 141.89 39.09 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 126.026 1.731 . . . . 0.0 110.082 176.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.49 ' H ' HD13 ' A' ' 109' ' ' LEU . 0.0 OUTLIER -89.39 168.09 12.5 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 -178.73 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -126.86 167.73 15.43 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.845 2.058 . . . . 0.0 113.08 -169.439 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 11.8 t . . . . . 0 N--CA 1.479 1.018 0 C-N-CA 124.115 0.966 . . . . 0.0 113.39 175.972 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 200' ' ' 44Z . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 . . . . . 0 CA--C 1.543 0.709 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 38.4 mm -110.06 126.34 67.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 125.151 1.38 . . . . 0.0 110.977 -178.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -140.85 34.94 1.77 Allowed 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 126.894 2.078 . . . . 0.0 110.741 170.325 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -94.37 -179.53 4.95 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 126.107 1.763 . . . . 0.0 112.384 -175.003 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 22.2 m -103.89 163.32 3.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 126.023 1.729 . . . . 0.0 110.907 173.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 43.8 mtt180 -92.24 140.7 24.46 Favored Pre-proline 0 N--CA 1.48 1.027 0 C-N-CA 124.098 0.959 . . . . 0.0 111.502 -176.628 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -76.34 176.72 9.7 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 123.667 2.912 . . . . 0.0 111.327 169.578 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt -68.19 153.39 43.84 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.547 0.739 . . . . 0.0 110.58 179.44 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 93.5 mt -60.65 -43.9 93.68 Favored Pre-proline 0 N--CA 1.478 0.946 0 N-CA-C 114.543 1.312 . . . . 0.0 114.543 -169.376 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -65.85 -26.2 52.3 Favored 'Trans proline' 0 C--N 1.353 0.794 0 CA-C-N 121.616 1.613 . . . . 0.0 113.287 172.184 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.39 -42.33 75.27 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.437 1.095 . . . . 0.0 110.948 174.776 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.7 tt -61.12 -36.7 80.45 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 120.969 -1.082 . . . . 0.0 111.292 170.042 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -63.77 -37.95 89.27 Favored 'General case' 0 N--CA 1.482 1.154 0 O-C-N 121.082 -1.011 . . . . 0.0 113.394 169.839 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.8 mt -60.26 -41.63 87.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 CA-C-N 120.238 1.381 . . . . 0.0 111.434 171.05 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.8 mp -66.61 -36.71 83.26 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 119.428 1.013 . . . . 0.0 112.133 174.175 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 28.5 m170 -63.36 -43.17 98.43 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 121.046 -1.034 . . . . 0.0 111.674 172.007 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.66 -28.31 69.83 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.266 1.027 . . . . 0.0 113.042 173.539 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.492 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -69.44 -15.07 63.21 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 124.155 0.982 . . . . 0.0 113.302 172.471 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 102.23 8.17 44.82 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 125.997 1.76 . . . . 0.0 114.884 -176.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -95.95 173.38 7.46 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 118.803 1.301 . . . . 0.0 113.901 -176.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.5 tm0? -136.77 143.28 43.15 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.921 1.688 . . . . 0.0 109.248 169.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 169.68 -179.73 41.94 Favored Glycine 0 N--CA 1.467 0.706 0 N-CA-C 115.241 0.856 . . . . 0.0 115.241 179.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -139.47 -57.23 0.58 Allowed 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.129 1.772 . . . . 0.0 110.824 -178.068 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 16.0 mtm -103.73 142.01 35.1 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 127.988 2.515 . . . . 0.0 111.257 173.165 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -154.79 144.99 21.9 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.292 1.037 . . . . 0.0 112.662 -176.138 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 43.7 p -76.12 172.04 13.48 Favored 'General case' 0 N--CA 1.484 1.263 0 O-C-N 121.121 -0.987 . . . . 0.0 111.094 168.334 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -56.76 -40.95 73.81 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.258 0 O-C-N 120.718 -1.239 . . . . 0.0 110.683 168.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -68.24 -40.76 81.91 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.429 1.092 . . . . 0.0 112.61 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 59.7 mt-10 -66.65 -40.99 88.93 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.591 0.756 . . . . 0.0 111.551 175.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 52.9 t -61.37 -48.58 88.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 O-C-N 121.785 -0.572 . . . . 0.0 110.841 171.525 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.43 -38.12 89.93 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 125.91 1.684 . . . . 0.0 113.955 -176.402 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 85.3 t60 -53.24 -51.6 61.65 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.297 0.639 . . . . 0.0 111.623 171.077 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -74.56 -32.48 62.43 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 176.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -71.85 -39.25 69.84 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.674 1.124 . . . . 0.0 112.564 178.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -60.4 -41.11 98.4 Favored Glycine 0 CA--C 1.536 1.393 0 CA-C-N 119.358 0.981 . . . . 0.0 111.732 171.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.6 tp60 -60.24 -51.37 69.86 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.479 1.512 . . . . 0.0 111.913 170.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.492 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 55.6 t80 -58.93 -49.99 75.73 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.0 -1.062 . . . . 0.0 110.397 179.766 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 56.7 mt -62.29 -36.51 74.94 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 124.896 1.278 . . . . 0.0 111.373 179.298 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 5.8 tpt -64.58 -40.08 94.89 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 119.6 1.091 . . . . 0.0 112.26 172.646 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 96.6 t -78.31 -34.08 18.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 124.293 1.037 . . . . 0.0 112.971 -179.052 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 47.4 mmtt -89.11 -15.68 33.31 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.89 1.276 . . . . 0.0 113.06 178.439 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 14.8 mp0 49.06 69.11 0.61 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.409 2.284 . . . . 0.0 112.601 -171.204 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 9.8 tp -90.74 -1.49 57.85 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.119 0.968 . . . . 0.0 112.776 -176.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -102.09 158.64 16.02 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.861 2.064 . . . . 0.0 111.184 175.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -88.47 127.69 35.52 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 169.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.26 -33.21 52.14 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.882 1.068 . . . . 0.0 113.882 179.553 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -90.38 -16.28 29.42 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.577 1.151 . . . . 0.0 112.466 -173.388 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -143.1 64.56 1.35 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 128.059 2.544 . . . . 0.0 109.432 -177.071 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -60.06 -21.82 61.92 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 121.241 -0.912 . . . . 0.0 113.053 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 5.6 p-80 -65.87 -6.55 12.55 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.31 1.444 . . . . 0.0 114.18 169.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 7.2 tpp -117.55 132.12 56.58 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 127.376 2.27 . . . . 0.0 110.379 174.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 11.7 t -115.4 123.28 70.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 126.017 1.727 . . . . 0.0 108.298 175.28 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 81.0 t80 -109.14 103.68 12.72 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.21 1.004 . . . . 0.0 109.913 -178.068 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 73.0 m -95.67 15.11 20.89 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -175.047 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.54 118.8 14.8 Favored Glycine 0 CA--C 1.535 1.334 0 O-C-N 121.468 -0.77 . . . . 0.0 112.093 179.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 76.96 5.62 84.86 Favored Glycine 0 CA--C 1.541 1.717 0 C-N-CA 124.485 1.04 . . . . 0.0 115.512 -175.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -93.79 158.66 15.55 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.189 1.494 . . . . 0.0 112.044 174.51 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 64.6 mt -48.96 -35.38 15.01 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.811 1.244 . . . . 0.0 113.286 177.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -58.88 -45.37 90.38 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.595 0.758 . . . . 0.0 111.743 175.037 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -74.7 -33.93 54.59 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 125.407 1.48 . . . . 0.0 113.902 176.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -59.32 -46.55 88.3 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-N 120.748 2.274 . . . . 0.0 110.096 171.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 32.0 tp -68.88 -51.63 38.16 Favored 'General case' 0 CA--C 1.552 1.054 0 CA-C-N 114.303 -1.317 . . . . 0.0 113.178 -176.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -89.55 -8.34 52.95 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 124.312 1.045 . . . . 0.0 112.608 -177.224 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 83.98 -27.04 4.56 Favored Glycine 0 CA--C 1.541 1.657 0 O-C-N 119.866 -1.771 . . . . 0.0 112.714 -169.566 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.12 140.31 4.39 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 128.55 2.74 . . . . 0.0 110.655 178.288 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -142.76 35.98 1.43 Allowed 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.795 0.838 . . . . 0.0 110.931 169.411 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 5.1 m -86.86 125.01 33.7 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 120.712 -1.242 . . . . 0.0 109.663 169.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -163.6 169.18 18.99 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.176 1.391 . . . . 0.0 111.859 -169.32 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 13.0 m -115.65 136.14 53.36 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.045 -0.98 . . . . 0.0 111.536 176.173 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -77.76 -14.35 14.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 124.483 1.113 . . . . 0.0 113.519 -169.205 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.2 pttt -75.26 -8.36 56.41 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.478 1.511 . . . . 0.0 114.651 169.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -117.99 83.88 20.05 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 126.394 1.878 . . . . 0.0 110.522 -175.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -67.08 -31.44 36.75 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 123.725 2.95 . . . . 0.0 114.855 -171.677 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 54.5 m -58.32 -51.97 77.96 Favored Pre-proline 0 N--CA 1.476 0.85 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -176.066 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -67.28 -33.98 28.82 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 121.88 1.72 . . . . 0.0 112.58 174.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 8.2 tp -60.38 -46.48 89.82 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.867 1.267 . . . . 0.0 110.878 176.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -56.97 -38.27 72.75 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.294 0.952 . . . . 0.0 112.52 177.257 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -64.76 -51.46 62.17 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.584 1.084 . . . . 0.0 112.379 177.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -68.52 -29.52 68.13 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 114.06 1.133 . . . . 0.0 114.06 177.538 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 39.7 tp -75.58 -53.54 8.45 Favored 'General case' 0 C--O 1.224 -0.255 0 C-N-CA 126.506 1.922 . . . . 0.0 110.972 178.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 49.9 mtp180 -59.48 -27.39 66.08 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-N 119.42 1.009 . . . . 0.0 113.474 -176.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -75.97 -26.4 56.76 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.297 1.439 . . . . 0.0 113.691 173.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 34.5 m-20 -104.75 -21.54 13.35 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 179.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 21.0 tp -137.05 110.16 7.76 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 127.916 2.487 . . . . 0.0 107.337 171.428 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 15.0 p -66.2 115.5 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-O 121.324 0.583 . . . . 0.0 110.495 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 7.7 t -161.84 -179.17 6.99 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.31 1.444 . . . . 0.0 111.203 -174.159 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -72.15 175.92 5.6 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.709 1.604 . . . . 0.0 114.348 176.749 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -125.56 164.07 21.35 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.295 1.838 . . . . 0.0 112.924 -171.372 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 66.4 p . . . . . 0 N--CA 1.483 1.182 0 C-N-CA 126.707 2.003 . . . . 0.0 113.966 174.167 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 200' ' ' 44Z . . . . . 0.432 ' CD3' ' CG1' ' A' ' 200' ' ' 44Z . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 . . . . . 0 CA--C 1.544 0.712 0 CA-C-O 121.14 0.495 . . . . 0.0 112.281 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.4 pp -71.8 160.75 5.1 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 C-N-CA 125.94 1.696 . . . . 0.0 113.266 177.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -81.47 -11.53 59.19 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -178.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 8.2 mm100 -68.4 162.2 25.91 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.831 2.052 . . . . 0.0 114.036 178.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.1 m -132.07 172.11 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 C-N-CA 125.808 1.643 . . . . 0.0 113.332 -169.148 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.403 ' HG2' ' HB3' ' A' ' 46' ' ' MET . 43.4 mtm180 -69.54 146.89 96.5 Favored Pre-proline 0 N--CA 1.486 1.371 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -169.567 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo -88.9 -177.14 1.56 Allowed 'Trans proline' 0 C--N 1.354 0.823 1 C-N-CA 125.392 4.061 . . . . 0.0 113.447 -176.304 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.0 ttmt -68.03 147.85 51.81 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.745 0.818 . . . . 0.0 109.128 169.182 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 92.4 mt -60.2 -42.07 87.67 Favored Pre-proline 0 N--CA 1.478 0.929 0 N-CA-C 115.354 1.612 . . . . 0.0 115.354 -168.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -59.58 -31.4 94.41 Favored 'Trans proline' 0 CA--C 1.537 0.631 0 CA-C-N 121.76 1.664 . . . . 0.0 114.032 176.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.1 tt -64.4 -44.77 90.22 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.071 0.851 . . . . 0.0 110.536 175.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 49.7 tp -61.11 -39.04 88.5 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.229 0.612 . . . . 0.0 111.797 175.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -67.21 -36.62 82.1 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 175.256 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 87.5 mt -63.89 -42.55 96.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 123.828 0.851 . . . . 0.0 111.346 171.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 97.7 mt -63.65 -37.2 86.45 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.154 -0.966 . . . . 0.0 112.661 173.143 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 65.2 m170 -61.76 -44.66 96.46 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 118.813 0.733 . . . . 0.0 111.581 169.804 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.76 -28.72 69.77 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.184 0.994 . . . . 0.0 112.976 177.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.438 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -73.99 -3.81 31.49 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.456 1.102 . . . . 0.0 113.552 172.445 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.81 12.32 60.74 Favored Glycine 0 CA--C 1.536 1.375 0 C-N-CA 125.177 1.37 . . . . 0.0 115.355 177.17 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -106.93 156.39 18.76 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.011 1.325 . . . . 0.0 112.736 -179.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -80.62 -178.48 6.76 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.684 -0.635 . . . . 0.0 111.07 169.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 176.79 155.01 12.56 Favored Glycine 0 C--N 1.34 0.781 0 N-CA-C 118.497 2.159 . . . . 0.0 118.497 176.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -147.01 -67.71 0.26 Allowed 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 127.227 2.211 . . . . 0.0 108.078 169.18 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.403 ' HB3' ' HG2' ' A' ' 28' ' ' ARG . 1.5 pmm? -130.09 154.63 47.27 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 126.214 1.806 . . . . 0.0 115.548 176.388 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -154.57 160.81 41.72 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 115.183 1.549 . . . . 0.0 115.183 -168.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 44.6 p -96.42 173.26 7.46 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 127.028 2.131 . . . . 0.0 109.893 167.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 1.2 t -56.54 -41.94 74.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 CA-C-N 120.785 1.629 . . . . 0.0 110.001 169.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 56.8 tptt -60.27 -43.17 96.43 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.729 1.15 . . . . 0.0 112.386 -179.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -74.12 -36.89 64.23 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 83.3 t -67.85 -50.57 58.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 CA-C-N 118.959 0.799 . . . . 0.0 111.013 172.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.6 ppp? -69.54 -26.52 64.54 Favored 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 114.55 1.315 . . . . 0.0 114.55 -168.572 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -57.77 -54.24 49.08 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.289 0.636 . . . . 0.0 110.826 171.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -74.54 -31.08 62.01 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 176.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -69.43 -39.1 78.06 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 120.61 1.55 . . . . 0.0 112.627 175.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.6 -47.36 89.81 Favored Glycine 0 CA--C 1.53 1.011 0 CA-C-N 118.986 0.812 . . . . 0.0 111.466 172.051 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.0 tp60 -57.62 -43.22 84.61 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.313 1.045 . . . . 0.0 112.356 172.503 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.438 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 59.4 t80 -62.79 -53.8 48.8 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.28 1.432 . . . . 0.0 110.621 177.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 34.7 mt -57.04 -37.36 54.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 124.288 1.035 . . . . 0.0 110.751 177.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 40.3 mmm -70.23 -41.47 73.55 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 114.141 1.163 . . . . 0.0 114.141 176.191 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.8 p -78.48 -26.31 13.92 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 CA-C-N 119.974 1.261 . . . . 0.0 112.99 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 55.5 mmtt -91.77 -14.44 29.87 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.817 1.647 . . . . 0.0 113.253 173.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.8 mp0 52.19 62.3 2.77 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 126.766 2.026 . . . . 0.0 113.673 -176.182 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 45.8 mt -88.37 -5.24 58.42 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 121.576 -0.703 . . . . 0.0 112.749 174.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 46.3 p90 -84.62 157.19 21.25 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.986 1.314 . . . . 0.0 111.703 172.573 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -87.41 126.83 35.11 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 169.454 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.46 -30.74 61.11 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 179.084 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -94.73 -21.08 18.98 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.712 1.205 . . . . 0.0 112.809 -170.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -140.07 68.44 1.36 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 127.765 2.426 . . . . 0.0 109.056 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -63.35 -16.96 61.99 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 114.05 1.13 . . . . 0.0 114.05 -169.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 32.8 p80 -61.53 -29.89 70.29 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 118.706 -0.664 . . . . 0.0 112.689 169.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 17.9 mtp -87.99 145.5 25.97 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 113.62 0.971 . . . . 0.0 113.62 176.186 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 t -131.0 131.21 64.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 C-N-CA 126.073 1.749 . . . . 0.0 108.743 173.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -112.66 103.57 11.61 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.553 1.541 . . . . 0.0 108.758 174.571 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 15.0 m -103.05 9.69 38.42 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.73 0.812 . . . . 0.0 112.402 176.008 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.75 -27.32 66.35 Favored Glycine 0 CA--C 1.537 1.444 0 C-N-CA 124.999 1.285 . . . . 0.0 114.795 -174.336 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -88.24 2.09 84.94 Favored Glycine 0 CA--C 1.54 1.631 0 C-N-CA 124.988 1.28 . . . . 0.0 115.202 173.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -110.67 177.78 4.57 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.471 1.508 . . . . 0.0 112.727 -175.061 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 80.4 mt -51.73 -35.84 44.79 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.205 1.402 . . . . 0.0 113.201 171.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 94.5 mt -61.2 -47.91 83.97 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 121.624 -0.673 . . . . 0.0 110.933 174.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -67.8 -34.79 83.76 Favored Glycine 0 CA--C 1.532 1.142 0 CA-C-O 119.032 -0.871 . . . . 0.0 113.464 176.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.42 -28.77 63.18 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 119.43 1.615 . . . . 0.0 112.449 176.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 40.8 tp -74.42 -53.61 9.23 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.875 1.27 . . . . 0.0 112.416 173.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -96.82 -17.24 20.34 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.787 1.403 . . . . 0.0 114.787 -169.442 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 80.85 -17.96 10.21 Favored Glycine 0 CA--C 1.539 1.584 0 C-N-CA 125.66 1.6 . . . . 0.0 116.061 -177.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.04 31.13 0.62 Allowed 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 116.362 1.986 . . . . 0.0 116.362 -174.23 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 8.0 mm-40 -69.35 73.17 0.33 Allowed 'General case' 0 N--CA 1.477 0.886 0 O-C-N 121.336 -0.852 . . . . 0.0 112.853 -179.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 12.1 m -134.38 136.43 43.36 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.083 1.353 . . . . 0.0 109.178 169.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 54.5 p90 -160.08 174.06 14.88 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -168.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.8 t -124.59 141.42 52.11 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 124.852 1.261 . . . . 0.0 110.548 169.019 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.548 HG21 ' CD5' ' A' ' 200' ' ' 44Z . 25.9 m -72.0 -12.28 15.73 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 175.21 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 41.4 pttt -77.35 -10.71 59.61 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 113.683 0.994 . . . . 0.0 113.683 172.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -123.48 77.42 54.54 Favored Pre-proline 0 CA--C 1.548 0.866 0 C-N-CA 126.285 1.834 . . . . 0.0 109.642 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -68.83 -28.05 30.44 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 123.389 2.726 . . . . 0.0 114.873 -169.355 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 62.5 m -59.4 -55.14 49.05 Favored Pre-proline 0 N--CA 1.476 0.863 0 CA-C-N 120.172 1.351 . . . . 0.0 114.436 -177.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -65.88 -29.74 49.65 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 122.11 1.873 . . . . 0.0 112.93 176.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 26.5 tp -66.37 -46.48 76.55 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.89 0.876 . . . . 0.0 110.746 174.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -61.83 -39.25 91.14 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 118.557 -0.735 . . . . 0.0 112.638 172.253 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -59.36 -48.9 79.88 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 119.778 1.172 . . . . 0.0 112.599 177.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 41.3 mtm -62.31 -47.91 82.2 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.653 0.781 . . . . 0.0 112.634 173.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 61.7 mt -56.65 -45.26 81.73 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 124.312 1.045 . . . . 0.0 110.978 177.373 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 24.0 ttt180 -60.42 -21.64 62.47 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 120.052 1.296 . . . . 0.0 114.234 175.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -86.85 -17.5 33.21 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.5 1.52 . . . . 0.0 113.208 172.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 53.9 t30 -104.92 -25.19 12.69 Favored 'General case' 0 CA--C 1.555 1.138 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 176.547 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 55.1 tp -131.21 133.04 45.11 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 128.739 2.816 . . . . 0.0 108.548 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 62.6 t -73.0 106.88 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 171.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 10.0 t -158.8 -172.83 3.97 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 125.045 1.338 . . . . 0.0 111.776 -174.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 3.0 pp -73.76 177.93 5.16 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.811 2.045 . . . . 0.0 114.41 176.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -124.14 167.66 13.95 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.2 1.8 . . . . 0.0 112.9 -172.441 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 8.8 t . . . . . 0 N--CA 1.48 1.029 0 C-N-CA 123.871 0.869 . . . . 0.0 113.284 175.473 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 200' ' ' 44Z . . . . . 0.548 ' CD5' HG21 ' A' ' 92' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 21.7 pt20 . . . . . 0 CA--C 1.544 0.723 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.0 mt -107.45 143.66 17.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 C-N-CA 125.658 1.583 . . . . 0.0 109.38 178.433 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 45.9 t30 -83.95 87.76 7.12 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.057 0.943 . . . . 0.0 110.436 173.188 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -88.53 -179.65 6.1 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 114.271 1.212 . . . . 0.0 114.271 -171.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 23.4 m -114.62 168.35 6.52 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 127.203 2.201 . . . . 0.0 109.675 169.013 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.7 ttp-105 -101.39 129.85 26.04 Favored Pre-proline 0 N--CA 1.481 1.099 0 O-C-N 120.876 -1.14 . . . . 0.0 111.408 178.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -75.24 -177.03 3.22 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.736 2.958 . . . . 0.0 112.121 173.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.5 ttmt -64.06 148.09 50.6 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 121.394 -0.816 . . . . 0.0 110.668 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.9 mt -55.84 -45.85 99.83 Favored Pre-proline 0 N--CA 1.476 0.836 0 N-CA-C 115.225 1.565 . . . . 0.0 115.225 -168.361 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -64.8 -24.17 61.8 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 CA-C-N 122.219 1.828 . . . . 0.0 113.773 175.096 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 tp -66.68 -40.26 88.49 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.774 1.17 . . . . 0.0 110.919 172.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.9 tt -63.37 -37.91 89.09 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.824 0.85 . . . . 0.0 111.41 171.3 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.433 ' HA ' ' HE2' ' A' ' 35' ' ' LYS . 11.1 mmpt? -60.99 -43.21 99.2 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 121.516 -0.74 . . . . 0.0 112.565 171.242 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 83.3 mt -62.75 -42.38 96.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.994 0.918 . . . . 0.0 111.5 174.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 55.8 mt -63.57 -38.61 91.79 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.473 -0.767 . . . . 0.0 111.671 176.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 17.6 m170 -67.67 -41.05 84.32 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.584 -0.697 . . . . 0.0 111.789 172.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.37 -26.83 68.93 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.182 0.993 . . . . 0.0 113.292 174.043 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.435 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -71.25 -6.78 42.31 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.154 0.982 . . . . 0.0 113.462 171.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 94.75 7.19 60.24 Favored Glycine 0 CA--C 1.536 1.397 0 C-N-CA 125.638 1.59 . . . . 0.0 115.063 -178.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -89.09 170.64 10.46 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 118.931 1.365 . . . . 0.0 112.874 178.189 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 34.4 tp60 -128.14 139.03 52.72 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.607 1.563 . . . . 0.0 109.013 169.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 175.94 150.8 8.28 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 115.275 0.87 . . . . 0.0 115.275 -179.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -125.06 13.39 8.4 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 127.023 2.129 . . . . 0.0 111.641 172.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.2 mtm -174.9 134.44 0.35 Allowed 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 128.916 2.886 . . . . 0.0 109.343 -172.146 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -154.08 143.88 21.78 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.192 0.997 . . . . 0.0 113.145 -174.588 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 51.4 p -85.75 170.06 12.82 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 121.058 -1.026 . . . . 0.0 111.203 168.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 2.7 t -55.81 -43.92 75.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 O-C-N 120.337 -1.477 . . . . 0.0 110.391 169.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -57.29 -34.69 68.94 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 120.813 -1.179 . . . . 0.0 113.002 177.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -80.43 -45.79 17.04 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 113.183 0.808 . . . . 0.0 113.183 173.618 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 79.5 t -61.61 -49.1 85.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 123.482 0.713 . . . . 0.0 110.895 -177.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.71 -38.58 83.81 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 123.375 0.67 . . . . 0.0 111.944 -172.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -56.46 -52.45 64.65 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.423 176.558 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 45.9 m-85 -74.41 -29.93 61.71 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 176.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.4 mp -68.28 -37.91 81.18 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 120.793 1.633 . . . . 0.0 112.215 171.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -61.95 -43.41 99.22 Favored Glycine 0 CA--C 1.531 1.069 0 CA-C-N 119.13 0.877 . . . . 0.0 111.828 171.549 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.2 tp60 -60.89 -43.09 98.96 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.394 1.077 . . . . 0.0 112.446 171.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.435 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 49.4 t80 -61.35 -51.78 67.37 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.205 1.002 . . . . 0.0 110.58 175.44 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 69.1 mt -59.8 -38.56 76.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 124.54 1.136 . . . . 0.0 110.825 179.095 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.2 tpt -63.63 -47.63 80.56 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.985 1.314 . . . . 0.0 112.509 174.127 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.2 p -78.63 -28.46 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 -175.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 57.5 mmtt -91.97 -15.78 27.48 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.459 1.503 . . . . 0.0 113.522 174.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.4 mp0 55.06 63.6 2.07 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.947 2.099 . . . . 0.0 112.992 -174.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 11.2 tp -88.29 -9.37 53.06 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.003 0.921 . . . . 0.0 112.3 176.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 26.4 p90 -88.58 162.08 16.57 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.134 1.774 . . . . 0.0 110.874 169.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -99.9 129.67 46.01 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 122.029 -0.42 . . . . 0.0 110.72 169.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.2 -20.57 59.29 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 113.934 1.087 . . . . 0.0 113.934 173.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -82.94 -31.44 27.7 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.639 1.176 . . . . 0.0 111.347 -178.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -152.33 69.99 0.9 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.262 1.825 . . . . 0.0 111.957 -169.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 27.9 mp0 -56.36 -20.8 20.91 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.233 1.413 . . . . 0.0 113.795 -178.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 30.5 p80 -65.32 -12.82 55.67 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 174.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 22.5 tpp -111.61 135.97 51.46 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 126.621 1.968 . . . . 0.0 111.105 172.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 18.9 t -119.7 107.89 22.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 125.713 1.605 . . . . 0.0 108.309 171.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -92.15 110.98 22.37 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.223 0.609 . . . . 0.0 110.672 -177.143 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 84.3 m -103.58 14.84 30.35 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 -170.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.47 120.74 23.6 Favored Glycine 0 CA--C 1.535 1.303 0 O-C-N 121.411 -0.805 . . . . 0.0 111.711 176.235 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 80.0 0.59 85.93 Favored Glycine 0 CA--C 1.54 1.625 0 C-N-CA 124.533 1.063 . . . . 0.0 115.575 -174.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -80.39 158.07 26.11 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.42 1.61 . . . . 0.0 111.496 171.191 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 10.9 mp -46.69 -41.16 14.51 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.312 1.445 . . . . 0.0 112.336 169.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 98.6 mt -57.52 -43.39 84.26 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.028 0.931 . . . . 0.0 111.703 174.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -72.64 -36.74 58.26 Favored Glycine 0 CA--C 1.53 0.981 0 CA-C-O 118.499 -1.167 . . . . 0.0 113.42 178.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -62.56 -42.55 99.61 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 120.318 2.059 . . . . 0.0 110.425 173.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 30.9 tp -65.34 -50.44 65.62 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.314 1.046 . . . . 0.0 113.191 -179.139 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -95.06 -7.64 38.98 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 124.782 1.233 . . . . 0.0 112.611 -175.363 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 82.47 -28.05 3.54 Favored Glycine 0 CA--C 1.541 1.662 0 C-N-CA 125.795 1.664 . . . . 0.0 113.167 -169.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.48 136.51 6.4 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 129.01 2.924 . . . . 0.0 109.265 176.544 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -139.32 22.96 2.55 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 119.267 0.939 . . . . 0.0 112.218 177.512 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 14.7 m -84.78 129.59 34.8 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 179.46 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 5.1 p90 -159.29 171.26 20.15 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.854 -1.066 . . . . 0.0 112.251 -168.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 79.9 p -113.39 136.26 52.96 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 114.659 -1.155 . . . . 0.0 113.434 177.122 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 3.7 m -77.65 -9.86 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 N-CA-C 114.066 1.136 . . . . 0.0 114.066 -177.243 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -80.91 -8.73 59.81 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.859 1.664 . . . . 0.0 115.149 174.227 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 39.0 t0 -131.29 90.11 39.24 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 125.519 1.527 . . . . 0.0 111.197 -172.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -67.46 -27.39 39.76 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 123.595 2.863 . . . . 0.0 115.08 -174.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 66.0 m -61.11 -53.16 66.21 Favored Pre-proline 0 N--CA 1.476 0.872 0 N-CA-C 114.326 1.232 . . . . 0.0 114.326 -177.562 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -66.6 -31.64 40.5 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 122.364 2.043 . . . . 0.0 112.761 175.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 6.5 tp -60.98 -49.02 79.12 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.779 1.232 . . . . 0.0 111.093 173.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -59.03 -29.26 67.15 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 -176.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -68.78 -51.52 40.14 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.604 1.093 . . . . 0.0 111.822 177.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 3.4 ptt? -68.86 -29.52 67.84 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.021 0.928 . . . . 0.0 112.633 178.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 17.7 tp -76.15 -47.13 25.44 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 126.821 2.049 . . . . 0.0 111.44 179.409 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 74.5 mtt180 -57.34 -27.47 62.27 Favored 'General case' 0 N--CA 1.485 1.282 0 CA-C-N 120.379 1.445 . . . . 0.0 113.16 176.08 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 90.4 mttt -76.49 -24.02 53.79 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.511 1.525 . . . . 0.0 113.509 174.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 60.2 m-20 -112.64 -22.23 10.86 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -177.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.6 tt -136.58 125.17 23.68 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 127.701 2.4 . . . . 0.0 108.265 -173.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 59.8 t -69.39 110.46 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 O-C-N 121.589 -0.694 . . . . 0.0 110.045 -179.394 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 12.4 t -148.91 165.62 31.02 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.964 1.706 . . . . 0.0 110.794 178.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.629 ' H ' HD13 ' A' ' 109' ' ' LEU . 0.0 OUTLIER -75.02 165.29 25.49 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 114.969 1.47 . . . . 0.0 114.969 -173.019 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -129.64 16.55 5.88 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 126.331 1.853 . . . . 0.0 114.59 -169.057 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 8.4 t . . . . . 0 N--CA 1.478 0.966 0 C-N-CA 125.585 1.554 . . . . 0.0 112.842 -176.552 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 200' ' ' 44Z . . . . . 0.422 ' CD3' ' CG1' ' A' ' 200' ' ' 44Z . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 . . . . . 0 CA--C 1.54 0.577 0 CA-C-O 121.914 0.864 . . . . 0.0 112.302 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 34.5 pt -94.95 1.04 10.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 C-N-CA 126.966 2.106 . . . . 0.0 115.519 -169.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 60.8 t30 55.39 13.88 1.0 Allowed 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 127.178 2.191 . . . . 0.0 115.39 -176.432 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.9 mm100 -112.98 167.74 10.27 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.704 2.001 . . . . 0.0 113.726 -172.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 24.1 m -134.53 172.5 16.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.984 0 C-N-CA 127.843 2.457 . . . . 0.0 110.869 -170.216 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 -79.7 144.55 60.72 Favored Pre-proline 0 N--CA 1.483 1.201 0 O-C-N 121.125 -0.984 . . . . 0.0 110.934 -172.525 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -73.12 176.71 8.75 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 123.542 2.828 . . . . 0.0 112.291 176.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -58.22 146.81 32.52 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.873 0.869 . . . . 0.0 110.054 173.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.1 mp -56.5 -46.41 99.82 Favored Pre-proline 0 N--CA 1.476 0.864 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -169.312 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -66.75 -25.27 46.4 Favored 'Trans proline' 0 C--N 1.351 0.687 0 CA-C-N 121.513 1.576 . . . . 0.0 113.706 176.007 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.1 tt -69.73 -40.84 75.97 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.235 0.925 . . . . 0.0 109.972 173.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 28.6 tp -59.6 -36.92 77.24 Favored 'General case' 0 CA--C 1.547 0.846 0 O-C-N 120.954 -1.091 . . . . 0.0 111.421 169.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 19.7 mmtp -67.1 -33.72 76.08 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 173.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 83.4 mt -62.29 -38.99 82.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 124.439 1.096 . . . . 0.0 111.728 170.687 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.7 mp -68.95 -37.22 78.73 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 120.076 1.307 . . . . 0.0 112.356 171.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 58.7 m170 -60.87 -43.55 98.26 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 119.22 0.918 . . . . 0.0 111.697 172.176 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.66 -23.44 67.26 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.939 1.296 . . . . 0.0 113.416 175.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.468 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -72.08 -6.7 44.33 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 123.711 0.804 . . . . 0.0 113.089 171.624 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.73 19.38 40.82 Favored Glycine 0 CA--C 1.536 1.351 0 C-N-CA 125.142 1.353 . . . . 0.0 114.712 178.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -126.24 145.27 50.47 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.868 1.267 . . . . 0.0 113.133 -175.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -74.5 153.6 39.05 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.915 0.886 . . . . 0.0 110.177 169.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -150.76 134.92 4.94 Favored Glycine 0 CA--C 1.529 0.922 0 N-CA-C 115.601 1.0 . . . . 0.0 115.601 179.479 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -148.88 78.57 1.4 Allowed 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 127.168 2.187 . . . . 0.0 108.847 173.592 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . 0.435 0.0 OUTLIER 64.87 141.01 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 129.536 3.134 . . . . 0.0 117.838 176.072 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -161.8 171.56 17.6 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 114.055 1.131 . . . . 0.0 114.055 -168.735 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 37.7 p -96.47 174.23 6.96 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 127.109 2.163 . . . . 0.0 112.523 169.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 15.9 t -50.19 -46.12 24.6 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 O-C-N 121.173 -0.954 . . . . 0.0 111.545 171.389 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -57.37 -38.51 74.33 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.752 0.821 . . . . 0.0 112.639 -176.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -80.51 -34.95 35.26 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.42 1.088 . . . . 0.0 112.948 176.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 73.2 t -72.79 -45.88 55.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 O-C-N 121.215 -0.928 . . . . 0.0 112.291 -179.759 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.419 ' SD ' ' CD2' ' A' ' 200' ' ' 44Z . 22.3 mmt -64.59 -30.66 71.68 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-N 120.012 1.278 . . . . 0.0 112.643 -178.303 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 85.4 t60 -53.85 -53.75 48.18 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.431 173.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -74.61 -34.27 62.79 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 174.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -70.29 -43.72 69.82 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.775 1.17 . . . . 0.0 112.814 -179.411 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.98 -39.68 98.37 Favored Glycine 0 CA--C 1.531 1.084 0 CA-C-N 118.843 0.747 . . . . 0.0 111.873 173.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.2 tp60 -61.18 -48.09 83.16 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.667 1.187 . . . . 0.0 111.934 172.146 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.468 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 66.3 t80 -60.7 -50.07 74.95 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.811 0.844 . . . . 0.0 110.885 177.29 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 60.4 mt -61.76 -35.76 69.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 124.817 1.247 . . . . 0.0 111.26 179.006 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.2 tpt -65.53 -39.52 91.87 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.595 1.158 . . . . 0.0 112.514 171.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 84.3 t -78.32 -32.97 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 CA-C-N 119.336 0.971 . . . . 0.0 112.969 -179.065 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 47.8 mmtt -90.46 -15.53 30.68 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.021 1.329 . . . . 0.0 113.15 177.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.3 mp0 50.17 66.45 1.14 Allowed 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 127.295 2.238 . . . . 0.0 113.183 -173.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 51.5 mt -91.2 0.64 57.49 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.52 0.728 . . . . 0.0 112.901 177.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 54.4 p90 -89.3 157.49 18.18 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.945 1.298 . . . . 0.0 111.354 171.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -88.52 134.58 33.82 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 121.86 -0.525 . . . . 0.0 110.69 169.69 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.47 -21.34 65.39 Favored 'General case' 0 CA--C 1.544 0.727 0 O-C-N 120.893 -1.129 . . . . 0.0 113.689 172.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -82.69 -34.57 27.32 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.704 1.202 . . . . 0.0 111.101 -179.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -147.89 76.35 1.38 Allowed 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 128.035 2.534 . . . . 0.0 109.43 -169.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 26.3 mp0 -59.34 -23.56 62.61 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.299 -0.876 . . . . 0.0 113.003 -178.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 3.3 p-80 -66.12 -23.22 66.45 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 171.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 12.6 tpp -87.06 132.05 33.93 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.758 1.223 . . . . 0.0 110.092 170.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.7 t -124.41 112.09 30.99 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 C-N-CA 126.577 1.951 . . . . 0.0 108.968 -175.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 58.0 t80 -89.98 59.26 4.47 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.411 1.485 . . . . 0.0 111.468 -176.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 52.5 m -72.28 -4.51 30.06 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 120.832 -1.168 . . . . 0.0 113.021 171.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.3 -24.65 59.27 Favored Glycine 0 CA--C 1.541 1.682 0 CA-C-N 120.648 1.567 . . . . 0.0 113.819 169.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -91.1 6.54 81.5 Favored Glycine 0 CA--C 1.542 1.778 0 C-N-CA 125.528 1.537 . . . . 0.0 115.326 171.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -112.13 171.1 7.71 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.249 1.82 . . . . 0.0 112.494 -173.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.1 mp -47.16 -40.23 15.37 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.244 1.418 . . . . 0.0 111.969 169.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.1 tp -64.76 -32.22 73.81 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.879 0.872 . . . . 0.0 111.945 175.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -75.11 -35.09 50.38 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 126.515 2.007 . . . . 0.0 114.458 174.331 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -65.63 -42.62 91.29 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 119.791 1.796 . . . . 0.0 110.232 169.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 25.6 tp -60.59 -49.33 77.96 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.155 1.382 . . . . 0.0 112.588 179.29 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.34 -11.09 21.52 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 115.478 1.658 . . . . 0.0 115.478 -177.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.11 -18.81 8.95 Favored Glycine 0 CA--C 1.539 1.59 0 C-N-CA 125.843 1.687 . . . . 0.0 115.968 179.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.33 28.64 0.57 Allowed 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 115.018 1.488 . . . . 0.0 115.018 -175.617 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -70.66 46.34 0.09 Allowed 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 116.212 1.93 . . . . 0.0 116.212 -168.21 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 41.0 m -105.93 142.41 35.68 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 120.789 -1.194 . . . . 0.0 110.491 170.155 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -161.39 171.4 18.31 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 -168.126 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 3.5 m -121.92 136.26 54.92 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.247 1.019 . . . . 0.0 111.389 174.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.476 HG21 ' CE5' ' A' ' 200' ' ' 44Z . 22.4 m -74.22 -21.65 17.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 C-N-CA 124.214 1.005 . . . . 0.0 113.707 -175.239 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -72.72 -8.58 56.06 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 125.335 1.454 . . . . 0.0 114.375 174.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 47.0 t0 -117.64 82.78 16.47 Favored Pre-proline 0 CA--C 1.547 0.851 0 C-N-CA 126.786 2.034 . . . . 0.0 109.097 -179.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -66.57 -31.9 40.25 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 123.478 2.785 . . . . 0.0 114.591 -169.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 55.7 m -56.7 -54.19 56.53 Favored Pre-proline 0 N--CA 1.476 0.856 0 CA-C-N 120.057 1.299 . . . . 0.0 113.949 -176.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -66.2 -28.52 47.98 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 122.071 1.847 . . . . 0.0 113.209 175.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 32.4 tp -69.61 -43.47 72.68 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.145 -0.972 . . . . 0.0 111.255 176.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -65.92 -34.3 77.8 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 121.496 -0.753 . . . . 0.0 112.329 171.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -63.08 -46.74 86.01 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.348 0.976 . . . . 0.0 112.578 175.006 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.488 ' HE3' ' HB2' ' A' ' 101' ' ' MET . 47.7 mtm -60.2 -49.92 75.73 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.244 0.618 . . . . 0.0 111.656 170.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 49.6 mt -59.92 -45.52 92.31 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-O 118.023 -0.989 . . . . 0.0 111.648 -176.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -55.09 -25.81 33.8 Favored 'General case' 0 N--CA 1.48 1.038 0 CA-C-N 119.926 1.239 . . . . 0.0 114.139 175.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -94.22 -16.77 23.34 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 125.322 1.449 . . . . 0.0 114.782 174.318 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 24.9 m-80 -117.95 -41.86 2.87 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-N 119.418 1.008 . . . . 0.0 113.598 -171.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 39.5 tp -102.78 95.94 6.52 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.614 1.966 . . . . 0.0 107.971 169.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 21.8 t -61.18 135.11 26.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-O 121.419 0.628 . . . . 0.0 110.941 -171.057 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 9.1 t -146.42 -172.73 4.02 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 126.358 1.863 . . . . 0.0 111.024 -170.391 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -83.06 25.83 0.66 Allowed 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.341 1.856 . . . . 0.0 114.385 -170.279 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -150.95 146.67 26.41 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.672 1.989 . . . . 0.0 111.268 -178.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 9.7 t . . . . . 0 N--CA 1.484 1.226 0 C-N-CA 126.897 2.079 . . . . 0.0 114.471 -176.829 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 200' ' ' 44Z . . . . . 0.476 ' CE5' HG21 ' A' ' 92' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 . . . . . 0 CA--C 1.544 0.739 0 CA-C-O 120.952 0.406 . . . . 0.0 111.703 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 34.4 mm -70.82 132.82 32.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 124.154 0.982 . . . . 0.0 111.073 178.312 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -131.0 17.38 5.09 Favored 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 126.398 1.879 . . . . 0.0 111.888 170.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -85.71 -179.41 6.85 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.858 2.063 . . . . 0.0 112.644 -178.187 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.1 m -103.68 172.05 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 126.302 1.841 . . . . 0.0 111.181 -178.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 42.8 ttp180 -110.42 134.98 20.68 Favored Pre-proline 0 N--CA 1.479 0.987 0 C-N-CA 124.195 0.998 . . . . 0.0 112.914 -169.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.01 159.2 54.08 Favored 'Trans proline' 0 CA--C 1.537 0.637 0 C-N-CA 122.367 2.044 . . . . 0.0 111.788 169.575 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -55.55 161.19 2.12 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 115.027 1.492 . . . . 0.0 115.027 177.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 22.2 mt -61.15 -41.72 82.26 Favored Pre-proline 0 CA--C 1.548 0.881 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 -168.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -70.08 -30.76 20.28 Favored 'Trans proline' 0 C--N 1.355 0.871 0 C-N-CA 122.152 1.901 . . . . 0.0 112.763 169.557 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 tt -71.95 -43.87 64.5 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.795 1.238 . . . . 0.0 110.841 -175.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 23.8 tp -53.65 -37.28 62.97 Favored 'General case' 0 CA--C 1.548 0.899 0 O-C-N 120.98 -1.075 . . . . 0.0 111.801 171.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -72.41 -19.18 61.64 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.198 0.999 . . . . 0.0 113.695 177.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 84.7 mt -69.49 -41.72 80.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 CA-C-N 118.988 0.813 . . . . 0.0 109.074 168.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.4 mp -66.73 -35.92 81.25 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 121.564 -0.71 . . . . 0.0 110.913 175.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 50.6 m170 -60.85 -49.51 77.17 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 118.362 0.528 . . . . 0.0 111.535 169.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.18 -23.85 67.62 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.525 1.13 . . . . 0.0 113.903 177.535 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.402 ' HB2' ' HB2' ' A' ' 59' ' ' TYR . . . -67.43 -14.83 63.28 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.402 1.081 . . . . 0.0 113.066 173.107 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.74 22.52 10.98 Favored Glycine 0 CA--C 1.537 1.415 0 C-N-CA 125.26 1.41 . . . . 0.0 114.557 179.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -132.42 154.9 49.38 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.83 1.252 . . . . 0.0 113.581 -174.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.9 tt0 -77.39 152.35 34.42 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.718 0.807 . . . . 0.0 110.128 169.534 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -144.73 126.17 2.58 Favored Glycine 0 N--CA 1.469 0.88 0 N-CA-C 114.88 0.712 . . . . 0.0 114.88 178.545 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -151.06 78.35 1.29 Allowed 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 126.748 2.019 . . . . 0.0 108.931 173.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 30.7 mtm 67.18 140.86 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 129.668 3.187 . . . . 0.0 117.112 174.189 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -170.41 166.03 8.58 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.983 1.313 . . . . 0.0 113.489 -169.506 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 66.9 p -74.04 167.69 21.01 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 125.188 1.395 . . . . 0.0 111.497 168.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -59.63 -39.07 78.55 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.387 0 O-C-N 120.5 -1.375 . . . . 0.0 111.904 174.029 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -62.28 -44.04 97.44 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.716 1.606 . . . . 0.0 112.876 176.146 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -67.84 -37.46 81.91 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 121.908 -0.495 . . . . 0.0 111.857 172.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 33.3 t -61.5 -43.91 97.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 123.617 0.767 . . . . 0.0 111.317 173.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.409 ' HB2' ' CD2' ' A' ' 200' ' ' 44Z . 19.4 ptp -73.08 -23.93 60.6 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 115.579 1.696 . . . . 0.0 115.579 -178.726 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 84.5 t60 -51.72 -44.04 63.07 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 118.73 0.695 . . . . 0.0 110.321 168.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 -74.79 -44.0 51.79 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 170.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.6 mp -67.25 -34.42 77.39 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 120.32 1.418 . . . . 0.0 113.873 -177.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.45 -47.37 87.98 Favored Glycine 0 CA--C 1.531 1.091 0 CA-C-N 119.222 0.919 . . . . 0.0 111.572 171.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 11.2 tp60 -54.93 -46.14 74.89 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.596 1.158 . . . . 0.0 111.604 171.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.402 ' HB2' ' HB2' ' A' ' 40' ' ' ALA . 68.8 t80 -62.55 -51.37 67.65 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.656 0.782 . . . . 0.0 110.828 179.826 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 67.8 mt -61.67 -37.24 77.51 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 123.758 0.823 . . . . 0.0 111.034 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 35.4 mmt -67.38 -42.45 83.36 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 174.043 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 6.6 p -78.54 -28.75 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 CA-C-N 119.869 1.213 . . . . 0.0 113.386 -177.246 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 57.4 mmtt -92.2 -15.83 27.04 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.905 1.282 . . . . 0.0 113.446 174.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 14.1 mp0 53.12 67.19 1.04 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.213 1.805 . . . . 0.0 113.06 -174.243 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.7 tp -90.31 3.83 52.51 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.34 1.056 . . . . 0.0 112.376 179.641 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 40.0 p90 -109.16 160.59 15.96 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 128.183 2.593 . . . . 0.0 110.725 178.194 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -94.54 130.71 40.84 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 109.273 -0.639 . . . . 0.0 109.273 168.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -57.03 -33.81 67.58 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 119.11 0.868 . . . . 0.0 112.737 -175.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -87.07 -15.13 39.48 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.873 0.869 . . . . 0.0 112.343 -172.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -141.97 57.47 1.48 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 127.875 2.47 . . . . 0.0 110.512 -176.303 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -60.31 -17.46 42.94 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 121.381 -0.824 . . . . 0.0 112.728 178.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 6.1 p-80 -63.42 -5.38 3.57 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.272 1.429 . . . . 0.0 114.332 169.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 48.1 mtp -128.35 150.75 49.96 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.97 1.259 . . . . 0.0 112.844 169.047 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 t -127.29 140.55 48.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 126.314 1.846 . . . . 0.0 108.243 175.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 86.1 m-85 -120.68 68.23 0.86 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.1 0.96 . . . . 0.0 112.622 -168.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 1.9 m -84.81 13.5 5.78 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 -170.269 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.82 -28.63 63.47 Favored Glycine 0 CA--C 1.541 1.705 0 O-C-N 120.473 -1.392 . . . . 0.0 114.663 178.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -94.15 5.95 72.04 Favored Glycine 0 CA--C 1.541 1.697 0 C-N-CA 125.358 1.456 . . . . 0.0 115.059 172.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -97.81 175.59 6.11 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.914 1.686 . . . . 0.0 112.53 -175.055 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 10.5 mp -59.56 -36.32 75.97 Favored 'General case' 0 CA--C 1.547 0.828 0 O-C-N 121.022 -1.048 . . . . 0.0 111.451 169.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 80.5 mt -57.64 -41.54 81.61 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.173 -0.954 . . . . 0.0 111.384 169.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -69.63 -35.3 74.11 Favored Glycine 0 CA--C 1.533 1.169 0 CA-C-O 118.709 -1.05 . . . . 0.0 113.821 176.084 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -72.94 -29.45 63.11 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 120.333 2.067 . . . . 0.0 111.477 176.398 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 29.2 tp -70.79 -50.47 35.4 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.104 1.362 . . . . 0.0 112.449 174.011 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.58 -6.4 23.9 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 124.628 1.171 . . . . 0.0 113.969 -171.182 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.47 -28.88 2.31 Favored Glycine 0 CA--C 1.54 1.647 0 C-N-CA 125.571 1.558 . . . . 0.0 113.759 -171.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.89 135.05 11.18 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 128.134 2.574 . . . . 0.0 110.005 176.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -148.54 42.75 0.99 Allowed 'General case' 0 N--CA 1.476 0.857 0 CA-C-O 122.283 1.039 . . . . 0.0 110.373 179.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 14.8 m -93.54 136.34 33.91 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 121.5 -0.75 . . . . 0.0 110.268 170.122 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 53.8 p90 -158.85 167.52 29.22 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.293 1.037 . . . . 0.0 113.497 -169.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 9.7 t -103.7 136.51 43.27 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.57 1.148 . . . . 0.0 111.468 170.29 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 5.5 m -77.83 -11.7 13.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 N-CA-C 114.859 1.429 . . . . 0.0 114.859 178.235 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 18.8 pttm -84.06 -8.53 59.09 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 115.26 1.578 . . . . 0.0 115.26 -176.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 42.2 t0 -120.58 96.22 48.93 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 126.148 1.779 . . . . 0.0 111.132 -169.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -60.37 -30.89 91.93 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 124.095 3.197 . . . . 0.0 115.315 -178.428 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 69.3 m -60.44 -55.02 49.24 Favored Pre-proline 0 N--CA 1.477 0.905 0 CA-C-N 120.264 1.393 . . . . 0.0 113.913 -177.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -67.1 -27.76 41.66 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 122.064 1.842 . . . . 0.0 112.795 175.182 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.423 HD22 ' CE3' ' A' ' 200' ' ' 44Z . 46.4 mt -61.45 -53.95 49.84 Favored 'General case' 0 C--N 1.344 0.341 0 CA-C-N 119.155 0.889 . . . . 0.0 110.535 173.184 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -58.94 -39.38 81.46 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.122 0.873 . . . . 0.0 113.012 176.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -58.67 -49.19 78.48 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 118.763 0.71 . . . . 0.0 112.572 177.435 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 45.2 mtm -68.14 -47.38 68.25 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.249 0.62 . . . . 0.0 112.317 175.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 69.4 mt -54.52 -47.98 72.48 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.229 1.012 . . . . 0.0 111.034 -178.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -59.56 -22.07 61.2 Favored 'General case' 0 N--CA 1.482 1.165 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 175.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -88.42 -22.05 23.94 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 125.977 1.711 . . . . 0.0 113.727 173.559 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -111.26 -33.72 6.36 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -170.59 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 42.7 tp -97.7 119.01 35.5 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.957 2.103 . . . . 0.0 108.938 169.137 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 21.4 t -68.84 132.71 32.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 176.57 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 5.2 t -149.65 -177.7 6.03 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.11 0.964 . . . . 0.0 112.426 -174.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -87.17 28.73 0.9 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.496 1.918 . . . . 0.0 114.385 -169.495 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -143.29 159.34 42.52 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.103 1.761 . . . . 0.0 112.836 -172.531 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 62.6 p . . . . . 0 N--CA 1.484 1.243 0 C-N-CA 127.274 2.229 . . . . 0.0 114.291 177.076 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 200' ' ' 44Z . . . . . 0.459 ' CD3' ' CG1' ' A' ' 200' ' ' 44Z . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_